N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine

C294H482F10N34O14S2 — CID 162020426

IUPACN,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(C(F)(F)F)nc1.CC(C)c1ccc(F)nc1.CC(C)c1cccc(CO)n1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccnc1C(F)(F)F.CC(C)c1cccnc1CO.CC(C)c1ccnc(F)c1.CC(C)c1ccncc1.CC(C)c1ccncc1CO.CC(C)c1ccsc1.CC(C)c1cnc(N(C)C)nc1.CC(C)c1cncc(C#N)c1.CC(C)c1cncc(F)c1.CC(C)c1cncc(N)c1.CC(C)c1cncc(S(C)(=O)=O)c1.CC(C)c1cncnc1.COC(=O)c1cccc(C(C)C)c1.COc1cc(C(C)C)ccn1.COc1ccc(C(C)C)c(CO)n1.COc1cncc(C(C)C)c1.COc1cncc(C(C)C)c1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)cnc1F.Cc1ccc(C(C)C)cn1.Cc1ccncc1C(C)C.Cc1cncc(C(C)C)c1.Cc1ncccc1C(C)C.Cc1nnc(-c2cccc(C(C)C)c2)o1
InChIInChI=1S/C12H14N2O.C11H14O2.C10H15NO2.2C9H10F3N.C9H12FN.C9H15N3.C9H10N2.C9H13NO2S.6C9H13NO.5C9H13N.3C8H10FN.C8H12N2.C8H11NO.3C8H11N.C7H10N2.C7H10S.30CH4/c1-8(2)10-5-4-6-11(7-10)12-14-13-9(3)15-12;1-8(2)9-5-4-6-10(7-9)11(12)13-3;1-7(2)8-4-5-10(13-3)11-9(8)6-12;1-6(2)7-3-4-8(13-5-7)9(10,11)12;1-6(2)7-4-3-5-13-8(7)9(10,11)12;1-6(2)8-4-7(3)9(10)11-5-8;1-7(2)8-5-10-9(11-6-8)12(3)4;1-7(2)9-3-8(4-10)5-11-6-9;1-7(2)8-4-9(6-10-5-8)13(3,11)12;2*1-7(2)8-4-9(11-3)6-10-5-8;1-7(2)8-4-5-10-9(6-8)11-3;1-7(2)9-3-4-10-5-8(9)6-11;1-7(2)8-4-3-5-10-9(8)6-11;1-7(2)9-5-3-4-8(6-11)10-9;1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-4-5-10-8(3)6-9;1-7(2)9-6-10-5-4-8(9)3;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-3-8(9)5-10-4-7;1-6(2)7-3-4-10-8(9)5-7;1-6(2)7-3-4-8(9)10-5-7;1-6(2)7-3-8(9)5-10-4-7;1-6(2)7-3-4-8(10)9-5-7;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-3-4-8-5-7;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h4-8H,1-3H3;4-8H,1-3H3;4-5,7,12H,6H2,1-3H3;2*3-6H,1-2H3;4-6H,1-3H3;5-7H,1-4H3;3,5-7H,1-2H3;4-7H,1-3H3;3*4-7H,1-3H3;3*3-5,7,11H,6H2,1-2H3;5*4-7H,1-3H3;3*3-6H,1-2H3;3-6H,9H2,1-2H3;3-6H,1-2H3,(H,9,10);3*3-7H,1-2H3;3-6H,1-2H3;3-6H,1-2H3;30*1H4
InChIKeyYURGTMXAQPZNGU-UHFFFAOYSA-N
MW4971.43 g/mol
LogP86.71
Rot. Bonds42

About N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine

N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine (PubChem CID 162020426) has the molecular formula C294H482F10N34O14S2 and a molecular weight of 4971.43 g/mol. Its IUPAC name is N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound NameN,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine
PubChem CID162020426
Molecular FormulaC294H482F10N34O14S2
Molecular Weight4971.43 g/mol
Exact Mass4967.73
IUPAC NameN,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(C(F)(F)F)nc1.CC(C)c1ccc(F)nc1.CC(C)c1cccc(CO)n1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccnc1C(F)(F)F.CC(C)c1cccnc1CO.CC(C)c1ccnc(F)c1.CC(C)c1ccncc1.CC(C)c1ccncc1CO.CC(C)c1ccsc1.CC(C)c1cnc(N(C)C)nc1.CC(C)c1cncc(C#N)c1.CC(C)c1cncc(F)c1.CC(C)c1cncc(N)c1.CC(C)c1cncc(S(C)(=O)=O)c1.CC(C)c1cncnc1.COC(=O)c1cccc(C(C)C)c1.COc1cc(C(C)C)ccn1.COc1ccc(C(C)C)c(CO)n1.COc1cncc(C(C)C)c1.COc1cncc(C(C)C)c1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)cnc1F.Cc1ccc(C(C)C)cn1.Cc1ccncc1C(C)C.Cc1cncc(C(C)C)c1.Cc1ncccc1C(C)C.Cc1nnc(-c2cccc(C(C)C)c2)o1
InChIInChI=1S/C12H14N2O.C11H14O2.C10H15NO2.2C9H10F3N.C9H12FN.C9H15N3.C9H10N2.C9H13NO2S.6C9H13NO.5C9H13N.3C8H10FN.C8H12N2.C8H11NO.3C8H11N.C7H10N2.C7H10S.30CH4/c1-8(2)10-5-4-6-11(7-10)12-14-13-9(3)15-12;1-8(2)9-5-4-6-10(7-9)11(12)13-3;1-7(2)8-4-5-10(13-3)11-9(8)6-12;1-6(2)7-3-4-8(13-5-7)9(10,11)12;1-6(2)7-4-3-5-13-8(7)9(10,11)12;1-6(2)8-4-7(3)9(10)11-5-8;1-7(2)8-5-10-9(11-6-8)12(3)4;1-7(2)9-3-8(4-10)5-11-6-9;1-7(2)8-4-9(6-10-5-8)13(3,11)12;2*1-7(2)8-4-9(11-3)6-10-5-8;1-7(2)8-4-5-10-9(6-8)11-3;1-7(2)9-3-4-10-5-8(9)6-11;1-7(2)8-4-3-5-10-9(8)6-11;1-7(2)9-5-3-4-8(6-11)10-9;1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-4-5-10-8(3)6-9;1-7(2)9-6-10-5-4-8(9)3;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-3-8(9)5-10-4-7;1-6(2)7-3-4-10-8(9)5-7;1-6(2)7-3-4-8(9)10-5-7;1-6(2)7-3-8(9)5-10-4-7;1-6(2)7-3-4-8(10)9-5-7;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-3-4-8-5-7;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h4-8H,1-3H3;4-8H,1-3H3;4-5,7,12H,6H2,1-3H3;2*3-6H,1-2H3;4-6H,1-3H3;5-7H,1-4H3;3,5-7H,1-2H3;4-7H,1-3H3;3*4-7H,1-3H3;3*3-5,7,11H,6H2,1-2H3;5*4-7H,1-3H3;3*3-6H,1-2H3;3-6H,9H2,1-2H3;3-6H,1-2H3,(H,9,10);3*3-7H,1-2H3;3-6H,1-2H3;3-6H,1-2H3;30*1H4
InChIKeyYURGTMXAQPZNGU-UHFFFAOYSA-N
XLogP86.71
TPSA664.03 Ų
H-Bond Donors6
H-Bond Acceptors48
Rotatable Bonds42
Heavy Atoms354
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004971.43
LogP ≤ 586.71
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1048

Analyze N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine with MolForge

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Launch Full Analysis

Related Compounds

CID 157704178
CID 157704178
CID 159583503
CID 159583503
CID 159699727
CID 159699727
CID 160391425
CID 160391425

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine?
The IUPAC name of N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine (CID 162020426) is N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine.
What is the SMILES notation for N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine?
The canonical SMILES for N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(C(F)(F)F)nc1.CC(C)c1ccc(F)nc1.CC(C)c1cccc(CO)n1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccnc1C(F)(F)F.CC(C)c1cccnc1CO.CC(C)c1ccnc(F)c1.CC(C)c1ccncc1.CC(C)c1ccncc1CO.CC(C)c1ccsc1.CC(C)c1cnc(N(C)C)nc1.CC(C)c1cncc(C#N)c1.CC(C)c1cncc(F)c1.CC(C)c1cncc(N)c1.CC(C)c1cncc(S(C)(=O)=O)c1.CC(C)c1cncnc1.COC(=O)c1cccc(C(C)C)c1.COc1cc(C(C)C)ccn1.COc1ccc(C(C)C)c(CO)n1.COc1cncc(C(C)C)c1.COc1cncc(C(C)C)c1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)cnc1F.Cc1ccc(C(C)C)cn1.Cc1ccncc1C(C)C.Cc1cncc(C(C)C)c1.Cc1ncccc1C(C)C.Cc1nnc(-c2cccc(C(C)C)c2)o1.
What is the InChIKey of N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine?
The InChIKey is YURGTMXAQPZNGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O.C11H14O2.C10H15NO2.2C9H10F3N.C9H12FN.C9H15N3.C9H10N2.C9H13NO2S.6C9H13NO.5C9H13N.3C8H10FN.C8H12N2.C8H11NO.3C8H11N.C7H10N2.C7H10S.30CH4/c1-8(2)10-5-4-6-11(7-10)12-14-13-9(3)15-12;1-8(2)9-5-4-6-10(7-9)11(12)13-3;1-7(2)8-4-5-10(13-3)11-9(8)6-12;1-6(2)7-3-4-8(13-5-7)9(10,11)12;1-6(2)7-4-3-5-13-8(7)9(10,11)12;1-6(2)8-4-7(3)9(10)11-5-8;1-7(2)8-5-10-9(11-6-8)12(3)4;1-7(2)9-3-8(4-10)5-11-6-9;1-7(2)8-4-9(6-10-5-8)13(3,11)12;2*1-7(2)8-4-9(11-3)6-10-5-8;1-7(2)8-4-5-10-9(6-8)11-3;1-7(2)9-3-4-10-5-8(9)6-11;1-7(2)8-4-3-5-10-9(8)6-11;1-7(2)9-5-3-4-8(6-11)10-9;1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-4-5-10-8(3)6-9;1-7(2)9-6-10-5-4-8(9)3;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-3-8(9)5-10-4-7;1-6(2)7-3-4-10-8(9)5-7;1-6(2)7-3-4-8(9)10-5-7;1-6(2)7-3-8(9)5-10-4-7;1-6(2)7-3-4-8(10)9-5-7;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-3-4-8-5-7;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h4-8H,1-3H3;4-8H,1-3H3;4-5,7,12H,6H2,1-3H3;2*3-6H,1-2H3;4-6H,1-3H3;5-7H,1-4H3;3,5-7H,1-2H3;4-7H,1-3H3;3*4-7H,1-3H3;3*3-5,7,11H,6H2,1-2H3;5*4-7H,1-3H3;3*3-6H,1-2H3;3-6H,9H2,1-2H3;3-6H,1-2H3,(H,9,10);3*3-7H,1-2H3;3-6H,1-2H3;3-6H,1-2H3;30*1H4.
What are the key properties of N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine?
N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine has a molecular weight of 4971.43 g/mol, XLogP of 86.71, 42 rotatable bonds, 6 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2-fluoro-3-methyl-5-propan-2-ylpyridine;2-fluoro-4-propan-2-ylpyridine;2-fluoro-5-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;methane;2-methoxy-4-propan-2-ylpyridine;bis(3-methoxy-5-propan-2-ylpyridine);(6-methoxy-3-propan-2-yl-2-pyridinyl)methanol;methyl 3-propan-2-ylbenzoate;2-methyl-5-(3-propan-2-ylphenyl)-1,3,4-oxadiazole;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;3-methylsulfonyl-5-propan-2-ylpyridine;5-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-3-carbonitrile;5-propan-2-yl-1H-pyridin-2-one;(3-propan-2-yl-2-pyridinyl)methanol;(4-propan-2-yl-3-pyridinyl)methanol;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-ylpyrimidine;3-propan-2-ylthiophene;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 162020426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).