2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole

C177H292FN51O5 — CID 167558235

IUPAC2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole
SMILESC=C1C=C(C(C)C)C=CN1C.C=C1C=C(C(C)C)C=NN1C.C=C1C=C(C(C)C)N=CN1C.CC(C)C1=CC(C)N(C)N=C1.CC(C)N1CCCN1.CC(C)c1cc[nH]c1.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(=O)n(C)c1.CC(C)c1cn(C)nn1.CC(C)c1cn[nH]n1.CC(C)c1cnc(=O)[nH]c1.CC(C)c1cnn(C)c1.CC(C)c1cnn(C)n1.CC(C)c1cnn(CF)c1.CC(C)n1cccn1.CC(C)n1ccnn1.CC(C)n1cncn1.CC(C)n1cnnc1.CC(C)n1nccn1.CCc1cc(C(C)C)ccn1.CCc1cc(C(C)C)cnn1.Cc1[nH]ncc1C(C)C.Cc1cnc(C(C)C)o1.Cc1ncc(C(C)C)o1.Cc1ncn(C(C)C)n1
InChIInChI=1S/2C10H15N.C9H14N2.C9H16N2.2C9H14N2.C9H13NO.C8H11NO.C7H11FN2.C7H10N2O.2C7H12N2.2C7H11NO.C7H11N.3C6H11N3.C6H14N2.C6H10N2.5C5H9N3/c1-8(2)10-5-6-11(4)9(3)7-10;1-4-10-7-9(8(2)3)5-6-11-10;1-7(2)9-5-8(3)11(4)6-10-9;2*1-7(2)9-5-8(3)11(4)10-6-9;1-4-9-5-8(7(2)3)6-10-11-9;1-7(2)8-4-5-9(11)10(3)6-8;1-6(2)7-3-4-8(10)9-5-7;1-6(2)7-3-9-10(4-7)5-8;1-5(2)6-3-8-7(10)9-4-6;1-6(2)7-4-8-9(3)5-7;1-5(2)7-4-8-9-6(7)3;1-5(2)7-4-8-6(3)9-7;1-5(2)7-8-4-6(3)9-7;1-6(2)7-3-4-8-5-7;1-5(2)6-4-9(3)8-7-6;1-5(2)6-4-7-9(3)8-6;1-5(2)9-4-7-6(3)8-9;2*1-6(2)8-5-3-4-7-8;1-5(2)8-3-6-7-4-8;1-5(2)8-4-6-3-7-8;1-5(2)8-4-3-6-7-8;1-5(2)8-6-3-4-7-8;1-4(2)5-3-6-8-7-5/h5-8H,3H2,1-2,4H3;5-8H,4H2,1-3H3;5-7H,3H2,1-2,4H3;5-8H,1-4H3;5-7H,3H2,1-2,4H3;5-7H,4H2,1-3H3;4-7H,1-3H3;3-6H,1-2H3,(H,9,10);3-4,6H,5H2,1-2H3;3-5H,1-2H3,(H,8,9,10);4-6H,1-3H3;4-5H,1-3H3,(H,8,9);2*4-5H,1-3H3;3-6,8H,1-2H3;3*4-5H,1-3H3;6-7H,3-5H2,1-2H3;3-6H,1-2H3;4*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8)
InChIKeyDHKALERJLXNUMJ-UHFFFAOYSA-N
MW3233.63 g/mol
LogP38.43
Rot. Bonds28

About 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole

2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole (PubChem CID 167558235) has the molecular formula C177H292FN51O5 and a molecular weight of 3233.63 g/mol. Its IUPAC name is 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole.

Molecular Properties

Compound Name2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole
PubChem CID167558235
Molecular FormulaC177H292FN51O5
Molecular Weight3233.63 g/mol
Exact Mass3231.41
IUPAC Name2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole
SMILESC=C1C=C(C(C)C)C=CN1C.C=C1C=C(C(C)C)C=NN1C.C=C1C=C(C(C)C)N=CN1C.CC(C)C1=CC(C)N(C)N=C1.CC(C)N1CCCN1.CC(C)c1cc[nH]c1.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(=O)n(C)c1.CC(C)c1cn(C)nn1.CC(C)c1cn[nH]n1.CC(C)c1cnc(=O)[nH]c1.CC(C)c1cnn(C)c1.CC(C)c1cnn(C)n1.CC(C)c1cnn(CF)c1.CC(C)n1cccn1.CC(C)n1ccnn1.CC(C)n1cncn1.CC(C)n1cnnc1.CC(C)n1nccn1.CCc1cc(C(C)C)ccn1.CCc1cc(C(C)C)cnn1.Cc1[nH]ncc1C(C)C.Cc1cnc(C(C)C)o1.Cc1ncc(C(C)C)o1.Cc1ncn(C(C)C)n1
InChIInChI=1S/2C10H15N.C9H14N2.C9H16N2.2C9H14N2.C9H13NO.C8H11NO.C7H11FN2.C7H10N2O.2C7H12N2.2C7H11NO.C7H11N.3C6H11N3.C6H14N2.C6H10N2.5C5H9N3/c1-8(2)10-5-6-11(4)9(3)7-10;1-4-10-7-9(8(2)3)5-6-11-10;1-7(2)9-5-8(3)11(4)6-10-9;2*1-7(2)9-5-8(3)11(4)10-6-9;1-4-9-5-8(7(2)3)6-10-11-9;1-7(2)8-4-5-9(11)10(3)6-8;1-6(2)7-3-4-8(10)9-5-7;1-6(2)7-3-9-10(4-7)5-8;1-5(2)6-3-8-7(10)9-4-6;1-6(2)7-4-8-9(3)5-7;1-5(2)7-4-8-9-6(7)3;1-5(2)7-4-8-6(3)9-7;1-5(2)7-8-4-6(3)9-7;1-6(2)7-3-4-8-5-7;1-5(2)6-4-9(3)8-7-6;1-5(2)6-4-7-9(3)8-6;1-5(2)9-4-7-6(3)8-9;2*1-6(2)8-5-3-4-7-8;1-5(2)8-3-6-7-4-8;1-5(2)8-4-6-3-7-8;1-5(2)8-4-3-6-7-8;1-5(2)8-6-3-4-7-8;1-4(2)5-3-6-8-7-5/h5-8H,3H2,1-2,4H3;5-8H,4H2,1-3H3;5-7H,3H2,1-2,4H3;5-8H,1-4H3;5-7H,3H2,1-2,4H3;5-7H,4H2,1-3H3;4-7H,1-3H3;3-6H,1-2H3,(H,9,10);3-4,6H,5H2,1-2H3;3-5H,1-2H3,(H,8,9,10);4-6H,1-3H3;4-5H,1-3H3,(H,8,9);2*4-5H,1-3H3;3-6,8H,1-2H3;3*4-5H,1-3H3;6-7H,3-5H2,1-2H3;3-6H,1-2H3;4*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8)
InChIKeyDHKALERJLXNUMJ-UHFFFAOYSA-N
XLogP38.43
TPSA611.12 Ų
H-Bond Donors6
H-Bond Acceptors51
Rotatable Bonds28
Heavy Atoms234
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003233.63
LogP ≤ 538.43
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1051

Analyze 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole with MolForge

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Launch Full Analysis

Related Compounds

2-tert-butyl-1H-imidazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;3-tert-butylpyridine;4-tert-butyl-2H-pyrrole;4-tert-butyl-3H-pyrrole;5-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;1-tert-butyl-1,2,4-triazole;bis(4-tert-butyl-2H-triazole);bis(5-tert-butyl-1H-1,2,4-triazole)
CID 157205327
2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;4-propan-2-yl-1H-pyrazole;bis(5-propan-2-yl-1H-pyrazole);3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole
CID 157740950
2-methylpropane;1-propan-2-ylimidazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole;4-propan-2-yl-1H-pyrazole;1-propan-2-yl-4,5,6,7-tetrahydrobenzimidazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;pyridine
CID 157743137
bis(1,4-dimethyl-2-propan-2-ylimidazole);bis(1,5-dimethyl-2-propan-2-ylimidazole);1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;1,2-dimethyl-5-propan-2-ylpyrrole;bis(1,3-dimethyl-2-propan-2-ylpyrrole);bis(1,3-dimethyl-4-propan-2-ylpyrrole);bis(1-methyl-2-propan-2-ylimidazole);tetrakis(5-methyl-2-propan-2-yl-1H-imidazole);5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-1-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-methyl-5-propan-2-yl-1H-pyrrole;3-methyl-2-propan-2-yl-1H-pyrrole;2-propan-2-yl-1H-imidazole;1,4,5-trimethyl-2-propan-2-ylimidazole;1,3,4-trimethyl-5-propan-2-ylpyrazole;1,2,4-trimethyl-3-propan-2-ylpyrrole;1,3,5-trimethyl-2-propan-2-ylpyrrole
CID 158079348
3-[(tert-butylamino)methyl]cyclohexa-2,4-dien-1-one;5-tert-butyl-1,3-oxazol-2-amine;2-(3,3-dimethylbutyl)-1H-benzimidazole;2-(3,3-dimethylbutyl)-4,5-dihydro-1H-imidazole;5-(3,3-dimethylbutyl)-3,4-dihydro-2H-pyrrole;2-(3,3-dimethylbutyl)-4,5-dimethyl-1H-imidazole;2-(3,3-dimethylbutyl)pyrimidine;3-(2,2-dimethylpropyl)-5-methyl-1,3-oxazol-2-one;3-(2,2-dimethylpropyl)-1,3-oxazolidin-2-one;3-(2,2-dimethylpropyl)-1,3-oxazol-2-one;N-(1H-imidazol-2-ylmethyl)-2-methylpropan-2-amine;2-methyl-N-[(3-methyl-1H-pyrrol-2-yl)methyl]propan-2-amine;2-methyl-N-(3H-pyrazol-5-ylmethyl)propan-2-amine;2-methyl-N-(pyridazin-3-ylmethyl)propan-2-amine;2-methyl-N-(2H-pyrrol-4-ylmethyl)propan-2-amine
CID 158168572
2-Tert-butyl-5-fluoropyrimidine;1-tert-butylimidazole;4-tert-butyl-2-methyltriazole;2-tert-butyl-1,3-oxazole;2-tert-butylpyrazine;1-tert-butylpyrazole;3-tert-butylpyridazine;4-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;1-tert-butyltetrazole;2-tert-butyl-1,3,5-triazine;1-tert-butyltriazole;1-tert-butyl-1,2,4-triazole;2-tert-butyltriazole;4-tert-butyl-1,2,4-triazole;1-methylpyrazole
CID 158251384
2,5-di(propan-2-yl)-1H-imidazole;3,5-di(propan-2-yl)pyridine;1,3-di(propan-2-yl)pyridin-2-one;2,5-di(propan-2-yl)pyrimidine;3,5-di(propan-2-yl)-1H-1,2,4-triazole;1-methyl-2,4-di(propan-2-yl)imidazole;1-methyl-2,5-di(propan-2-yl)imidazole;4-methyl-3,5-di(propan-2-yl)-1,2,4-triazole
CID 158533181
3-[(tert-butylamino)methyl]cyclohexa-2,4-dien-1-one;5-tert-butyl-1,3-oxazol-2-amine;5-(3,3-dimethylbutyl)-3,4-dihydro-2H-pyrrole;2-(3,3-dimethylbutyl)pyrimidine;3-(2,2-dimethylpropyl)-5-methyl-1,3-oxazol-2-one;3-(2,2-dimethylpropyl)-1,3-oxazolidin-2-one;3-(2,2-dimethylpropyl)-1,3-oxazol-2-one;N-(1H-imidazol-2-ylmethyl)-2-methylpropan-2-amine;2-methyl-N-[(3-methyl-1H-pyrrol-2-yl)methyl]propan-2-amine;2-methyl-N-(3H-pyrazol-5-ylmethyl)propan-2-amine;2-methyl-N-(pyridazin-3-ylmethyl)propan-2-amine;2-methyl-N-(2H-pyrrol-4-ylmethyl)propan-2-amine
CID 158546153
2-tert-butylpyrimidine;1,3-dimethyl-4-propan-2-ylpyrazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;1-ethyl-4-propan-2-ylpyrazole;methane;1-methyl-2-propan-2-ylimidazole;5-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-yl-1,2,4-triazole;2-propan-2-yl-1H-imidazole;1-propan-2-ylpyrrolidine
CID 158884399
2-methylpropane;2-propan-2-yl-4,5-dihydro-1H-imidazole;1-propan-2-ylimidazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;1-propan-2-ylpyrrole;1-propan-2-yl-4,5,6,7-tetrahydrobenzimidazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole;pyridine
CID 159238889
2-tert-butyl-1H-imidazole;5-tert-butyl-1H-imidazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;3-tert-butylpyridine;4-tert-butyl-2H-pyrrole;5-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;1-tert-butyl-1,2,4-triazole;bis(4-tert-butyl-2H-triazole);bis(5-tert-butyl-1H-1,2,4-triazole)
CID 159295876
2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)-1,3,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;3,5-di(propan-2-yl)-1H-pyrazole;2,4-di(propan-2-yl)-1H-pyrimidin-6-one;1,4-di(propan-2-yl)triazole;2,4-di(propan-2-yl)triazole;3,5-di(propan-2-yl)-1H-1,2,4-triazole;methane;5-(3-methylbut-1-ynyl)-2-propan-2-yl-1H-imidazole;2-methyl-N-propan-2-ylpropanamide;2-(2-methylpropyl)-5-propan-2-yl-1H-imidazole;2-propan-2-yl-5-(4-propan-2-ylphenyl)-1H-imidazole
CID 159853826

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole?
The IUPAC name of 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole (CID 167558235) is 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole.
What is the SMILES notation for 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole?
The canonical SMILES for 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole is C=C1C=C(C(C)C)C=CN1C.C=C1C=C(C(C)C)C=NN1C.C=C1C=C(C(C)C)N=CN1C.CC(C)C1=CC(C)N(C)N=C1.CC(C)N1CCCN1.CC(C)c1cc[nH]c1.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(=O)n(C)c1.CC(C)c1cn(C)nn1.CC(C)c1cn[nH]n1.CC(C)c1cnc(=O)[nH]c1.CC(C)c1cnn(C)c1.CC(C)c1cnn(C)n1.CC(C)c1cnn(CF)c1.CC(C)n1cccn1.CC(C)n1ccnn1.CC(C)n1cncn1.CC(C)n1cnnc1.CC(C)n1nccn1.CCc1cc(C(C)C)ccn1.CCc1cc(C(C)C)cnn1.Cc1[nH]ncc1C(C)C.Cc1cnc(C(C)C)o1.Cc1ncc(C(C)C)o1.Cc1ncn(C(C)C)n1.
What is the InChIKey of 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole?
The InChIKey is DHKALERJLXNUMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H15N.C9H14N2.C9H16N2.2C9H14N2.C9H13NO.C8H11NO.C7H11FN2.C7H10N2O.2C7H12N2.2C7H11NO.C7H11N.3C6H11N3.C6H14N2.C6H10N2.5C5H9N3/c1-8(2)10-5-6-11(4)9(3)7-10;1-4-10-7-9(8(2)3)5-6-11-10;1-7(2)9-5-8(3)11(4)6-10-9;2*1-7(2)9-5-8(3)11(4)10-6-9;1-4-9-5-8(7(2)3)6-10-11-9;1-7(2)8-4-5-9(11)10(3)6-8;1-6(2)7-3-4-8(10)9-5-7;1-6(2)7-3-9-10(4-7)5-8;1-5(2)6-3-8-7(10)9-4-6;1-6(2)7-4-8-9(3)5-7;1-5(2)7-4-8-9-6(7)3;1-5(2)7-4-8-6(3)9-7;1-5(2)7-8-4-6(3)9-7;1-6(2)7-3-4-8-5-7;1-5(2)6-4-9(3)8-7-6;1-5(2)6-4-7-9(3)8-6;1-5(2)9-4-7-6(3)8-9;2*1-6(2)8-5-3-4-7-8;1-5(2)8-3-6-7-4-8;1-5(2)8-4-6-3-7-8;1-5(2)8-4-3-6-7-8;1-5(2)8-6-3-4-7-8;1-4(2)5-3-6-8-7-5/h5-8H,3H2,1-2,4H3;5-8H,4H2,1-3H3;5-7H,3H2,1-2,4H3;5-8H,1-4H3;5-7H,3H2,1-2,4H3;5-7H,4H2,1-3H3;4-7H,1-3H3;3-6H,1-2H3,(H,9,10);3-4,6H,5H2,1-2H3;3-5H,1-2H3,(H,8,9,10);4-6H,1-3H3;4-5H,1-3H3,(H,8,9);2*4-5H,1-3H3;3-6,8H,1-2H3;3*4-5H,1-3H3;6-7H,3-5H2,1-2H3;3-6H,1-2H3;4*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8).
What are the key properties of 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole?
2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole has a molecular weight of 3233.63 g/mol, XLogP of 38.43, 28 rotatable bonds, 6 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-5-propan-2-yl-3H-pyridazine;3-ethyl-5-propan-2-ylpyridazine;2-ethyl-4-propan-2-ylpyridine;1-(fluoromethyl)-4-propan-2-ylpyrazole;1-methyl-6-methylidene-4-propan-2-ylpyridazine;1-methyl-2-methylidene-4-propan-2-ylpyridine;1-methyl-6-methylidene-4-propan-2-ylpyrimidine;2-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1H-pyrazole;1-methyl-5-propan-2-ylpyridin-2-one;1-methyl-4-propan-2-yltriazole;2-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;1-propan-2-ylpyrazolidine;5-propan-2-yl-1H-pyridin-2-one;5-propan-2-yl-1H-pyrimidin-2-one;3-propan-2-yl-1H-pyrrole;1-propan-2-yltriazole;1-propan-2-yl-1,2,4-triazole;2-propan-2-yltriazole;4-propan-2-yl-1,2,4-triazole;4-propan-2-yl-2H-triazole is sourced from PubChem (CID 167558235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).