1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine

C176H224N26O5S7 — CID 158484259

IUPAC1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine
SMILESC=S(N)(=O)c1ccc(C(C)C)cc1.CC(=O)c1ccc(C(C)C)cc1.CC(C)c1cc(-c2cnco2)ccn1.CC(C)c1cccc(-c2cccnc2)c1.CC(C)c1cccc(-c2cccnc2)n1.CC(C)c1cccc(-c2ccsc2)n1.CC(C)c1cccc(C2=CCC=C2)n1.CC(C)c1cccc(C2=CCOCC2)n1.CC(C)c1nnc(-c2ccccc2)s1.CC(C)c1nnc(-c2cccnc2)s1.CC(C)c1nnc(C(C)(C)C)s1.CCCn1cc(-c2cccc(C(C)C)n2)cn1.CCc1nnc(C(C)C)s1.Cc1cccc(C(C)C)n1.Cc1nnc(C(C)C)s1.Cc1noc(C)c1-c1cccc(C(C)C)n1
InChIInChI=1S/C14H19N3.C14H15N.C13H16N2O.C13H14N2.C13H17NO.C13H15N.C12H13NS.C11H12N2O.C11H12N2S.C11H14O.C10H11N3S.C10H15NOS.C9H16N2S.C9H13N.C7H12N2S.C6H10N2S/c1-4-8-17-10-12(9-15-17)14-7-5-6-13(16-14)11(2)3;1-11(2)12-5-3-6-13(9-12)14-7-4-8-15-10-14;1-8(2)11-6-5-7-12(14-11)13-9(3)15-16-10(13)4;1-10(2)12-6-3-7-13(15-12)11-5-4-8-14-9-11;1-10(2)12-4-3-5-13(14-12)11-6-8-15-9-7-11;1-10(2)12-8-5-9-13(14-12)11-6-3-4-7-11;1-9(2)11-4-3-5-12(13-11)10-6-7-14-8-10;1-8(2)10-5-9(3-4-13-10)11-6-12-7-14-11;1-8(2)10-12-13-11(14-10)9-6-4-3-5-7-9;1-8(2)10-4-6-11(7-5-10)9(3)12;1-7(2)9-12-13-10(14-9)8-4-3-5-11-6-8;1-8(2)9-4-6-10(7-5-9)13(3,11)12;1-6(2)7-10-11-8(12-7)9(3,4)5;1-7(2)9-6-4-5-8(3)10-9;1-4-6-8-9-7(10-6)5(2)3;1-4(2)6-8-7-5(3)9-6/h5-7,9-11H,4,8H2,1-3H3;3-11H,1-2H3;5-8H,1-4H3;3-10H,1-2H3;3-6,10H,7-9H2,1-2H3;3,5-10H,4H2,1-2H3;3-9H,1-2H3;2*3-8H,1-2H3;4-8H,1-3H3;3-7H,1-2H3;4-8H,3H2,1-2H3,(H2,11,12);6H,1-5H3;4-7H,1-3H3;5H,4H2,1-3H3;4H,1-3H3
InChIKeyHHWZMJOKVBWXTL-UHFFFAOYSA-N
MW3008.37 g/mol
LogP47.93
Rot. Bonds31

About 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine

1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine (PubChem CID 158484259) has the molecular formula C176H224N26O5S7 and a molecular weight of 3008.37 g/mol. Its IUPAC name is 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine.

Molecular Properties

Compound Name1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine
PubChem CID158484259
Molecular FormulaC176H224N26O5S7
Molecular Weight3008.37 g/mol
Exact Mass3005.61
IUPAC Name1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine
SMILESC=S(N)(=O)c1ccc(C(C)C)cc1.CC(=O)c1ccc(C(C)C)cc1.CC(C)c1cc(-c2cnco2)ccn1.CC(C)c1cccc(-c2cccnc2)c1.CC(C)c1cccc(-c2cccnc2)n1.CC(C)c1cccc(-c2ccsc2)n1.CC(C)c1cccc(C2=CCC=C2)n1.CC(C)c1cccc(C2=CCOCC2)n1.CC(C)c1nnc(-c2ccccc2)s1.CC(C)c1nnc(-c2cccnc2)s1.CC(C)c1nnc(C(C)(C)C)s1.CCCn1cc(-c2cccc(C(C)C)n2)cn1.CCc1nnc(C(C)C)s1.Cc1cccc(C(C)C)n1.Cc1nnc(C(C)C)s1.Cc1noc(C)c1-c1cccc(C(C)C)n1
InChIInChI=1S/C14H19N3.C14H15N.C13H16N2O.C13H14N2.C13H17NO.C13H15N.C12H13NS.C11H12N2O.C11H12N2S.C11H14O.C10H11N3S.C10H15NOS.C9H16N2S.C9H13N.C7H12N2S.C6H10N2S/c1-4-8-17-10-12(9-15-17)14-7-5-6-13(16-14)11(2)3;1-11(2)12-5-3-6-13(9-12)14-7-4-8-15-10-14;1-8(2)11-6-5-7-12(14-11)13-9(3)15-16-10(13)4;1-10(2)12-6-3-7-13(15-12)11-5-4-8-14-9-11;1-10(2)12-4-3-5-13(14-12)11-6-8-15-9-7-11;1-10(2)12-8-5-9-13(14-12)11-6-3-4-7-11;1-9(2)11-4-3-5-12(13-11)10-6-7-14-8-10;1-8(2)10-5-9(3-4-13-10)11-6-12-7-14-11;1-8(2)10-12-13-11(14-10)9-6-4-3-5-7-9;1-8(2)10-4-6-11(7-5-10)9(3)12;1-7(2)9-12-13-10(14-9)8-4-3-5-11-6-8;1-8(2)9-4-6-10(7-5-9)13(3,11)12;1-6(2)7-10-11-8(12-7)9(3,4)5;1-7(2)9-6-4-5-8(3)10-9;1-4-6-8-9-7(10-6)5(2)3;1-4(2)6-8-7-5(3)9-6/h5-7,9-11H,4,8H2,1-3H3;3-11H,1-2H3;5-8H,1-4H3;3-10H,1-2H3;3-6,10H,7-9H2,1-2H3;3,5-10H,4H2,1-2H3;3-9H,1-2H3;2*3-8H,1-2H3;4-8H,1-3H3;3-7H,1-2H3;4-8H,3H2,1-2H3,(H2,11,12);6H,1-5H3;4-7H,1-3H3;5H,4H2,1-3H3;4H,1-3H3
InChIKeyHHWZMJOKVBWXTL-UHFFFAOYSA-N
XLogP47.93
TPSA409.96 Ų
H-Bond Donors1
H-Bond Acceptors36
Rotatable Bonds31
Heavy Atoms214
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003008.37
LogP ≤ 547.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine?
The IUPAC name of 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine (CID 158484259) is 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine.
What is the SMILES notation for 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine?
The canonical SMILES for 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine is C=S(N)(=O)c1ccc(C(C)C)cc1.CC(=O)c1ccc(C(C)C)cc1.CC(C)c1cc(-c2cnco2)ccn1.CC(C)c1cccc(-c2cccnc2)c1.CC(C)c1cccc(-c2cccnc2)n1.CC(C)c1cccc(-c2ccsc2)n1.CC(C)c1cccc(C2=CCC=C2)n1.CC(C)c1cccc(C2=CCOCC2)n1.CC(C)c1nnc(-c2ccccc2)s1.CC(C)c1nnc(-c2cccnc2)s1.CC(C)c1nnc(C(C)(C)C)s1.CCCn1cc(-c2cccc(C(C)C)n2)cn1.CCc1nnc(C(C)C)s1.Cc1cccc(C(C)C)n1.Cc1nnc(C(C)C)s1.Cc1noc(C)c1-c1cccc(C(C)C)n1.
What is the InChIKey of 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine?
The InChIKey is HHWZMJOKVBWXTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3.C14H15N.C13H16N2O.C13H14N2.C13H17NO.C13H15N.C12H13NS.C11H12N2O.C11H12N2S.C11H14O.C10H11N3S.C10H15NOS.C9H16N2S.C9H13N.C7H12N2S.C6H10N2S/c1-4-8-17-10-12(9-15-17)14-7-5-6-13(16-14)11(2)3;1-11(2)12-5-3-6-13(9-12)14-7-4-8-15-10-14;1-8(2)11-6-5-7-12(14-11)13-9(3)15-16-10(13)4;1-10(2)12-6-3-7-13(15-12)11-5-4-8-14-9-11;1-10(2)12-4-3-5-13(14-12)11-6-8-15-9-7-11;1-10(2)12-8-5-9-13(14-12)11-6-3-4-7-11;1-9(2)11-4-3-5-12(13-11)10-6-7-14-8-10;1-8(2)10-5-9(3-4-13-10)11-6-12-7-14-11;1-8(2)10-12-13-11(14-10)9-6-4-3-5-7-9;1-8(2)10-4-6-11(7-5-10)9(3)12;1-7(2)9-12-13-10(14-9)8-4-3-5-11-6-8;1-8(2)9-4-6-10(7-5-9)13(3,11)12;1-6(2)7-10-11-8(12-7)9(3,4)5;1-7(2)9-6-4-5-8(3)10-9;1-4-6-8-9-7(10-6)5(2)3;1-4(2)6-8-7-5(3)9-6/h5-7,9-11H,4,8H2,1-3H3;3-11H,1-2H3;5-8H,1-4H3;3-10H,1-2H3;3-6,10H,7-9H2,1-2H3;3,5-10H,4H2,1-2H3;3-9H,1-2H3;2*3-8H,1-2H3;4-8H,1-3H3;3-7H,1-2H3;4-8H,3H2,1-2H3,(H2,11,12);6H,1-5H3;4-7H,1-3H3;5H,4H2,1-3H3;4H,1-3H3.
What are the key properties of 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine?
1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine has a molecular weight of 3008.37 g/mol, XLogP of 47.93, 31 rotatable bonds, 1 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(amino-methylidene-oxo-λ6-sulfanyl)-4-propan-2-ylbenzene;2-tert-butyl-5-propan-2-yl-1,3,4-thiadiazole;2-cyclopenta-1,4-dien-1-yl-6-propan-2-ylpyridine;2-(3,6-dihydro-2H-pyran-4-yl)-6-propan-2-ylpyridine;3,5-dimethyl-4-(6-propan-2-yl-2-pyridinyl)-1,2-oxazole;2-ethyl-5-propan-2-yl-1,3,4-thiadiazole;2-methyl-6-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;2-phenyl-5-propan-2-yl-1,3,4-thiadiazole;1-(4-propan-2-ylphenyl)ethanone;3-(3-propan-2-ylphenyl)pyridine;2-propan-2-yl-6-(1-propylpyrazol-4-yl)pyridine;5-(2-propan-2-yl-4-pyridinyl)-1,3-oxazole;2-propan-2-yl-6-pyridin-3-ylpyridine;2-propan-2-yl-5-pyridin-3-yl-1,3,4-thiadiazole;2-propan-2-yl-6-thiophen-3-ylpyridine is sourced from PubChem (CID 158484259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).