2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine

C97H92F6N16O2 — CID 159028419

IUPAC2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESC=C(Cc1nc2cccc(-c3ccc(C(=O)N(C)C)cc3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3ccc(C(F)(F)F)cc3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3cccc(C(F)(F)F)c3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3cccc(C)c3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3cccc(CO)c3)n2n1)C1CC1
InChIInChI=1S/C21H22N4O.2C19H16F3N3.C19H19N3O.C19H19N3/c1-14(15-7-8-15)13-19-22-20-6-4-5-18(25(20)23-19)16-9-11-17(12-10-16)21(26)24(2)3;1-12(13-8-9-13)10-17-23-18-7-3-6-16(25(18)24-17)14-4-2-5-15(11-14)19(20,21)22;1-12(13-5-6-13)11-17-23-18-4-2-3-16(25(18)24-17)14-7-9-15(10-8-14)19(20,21)22;1-13(15-8-9-15)10-18-20-19-7-3-6-17(22(19)21-18)16-5-2-4-14(11-16)12-23;1-13-5-3-6-16(11-13)17-7-4-8-19-20-18(21-22(17)19)12-14(2)15-9-10-15/h4-6,9-12,15H,1,7-8,13H2,2-3H3;2-7,11,13H,1,8-10H2;2-4,7-10,13H,1,5-6,11H2;2-7,11,15,23H,1,8-10,12H2;3-8,11,15H,2,9-10,12H2,1H3
InChIKeyJUOKZGVSKGBUQJ-UHFFFAOYSA-N
MW1627.90 g/mol
LogP21.07
Rot. Bonds22

About 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine

2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 159028419) has the molecular formula C97H92F6N16O2 and a molecular weight of 1627.90 g/mol. Its IUPAC name is 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID159028419
Molecular FormulaC97H92F6N16O2
Molecular Weight1627.90 g/mol
Exact Mass1626.75
IUPAC Name2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESC=C(Cc1nc2cccc(-c3ccc(C(=O)N(C)C)cc3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3ccc(C(F)(F)F)cc3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3cccc(C(F)(F)F)c3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3cccc(C)c3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3cccc(CO)c3)n2n1)C1CC1
InChIInChI=1S/C21H22N4O.2C19H16F3N3.C19H19N3O.C19H19N3/c1-14(15-7-8-15)13-19-22-20-6-4-5-18(25(20)23-19)16-9-11-17(12-10-16)21(26)24(2)3;1-12(13-8-9-13)10-17-23-18-7-3-6-16(25(18)24-17)14-4-2-5-15(11-14)19(20,21)22;1-12(13-5-6-13)11-17-23-18-4-2-3-16(25(18)24-17)14-7-9-15(10-8-14)19(20,21)22;1-13(15-8-9-15)10-18-20-19-7-3-6-17(22(19)21-18)16-5-2-4-14(11-16)12-23;1-13-5-3-6-16(11-13)17-7-4-8-19-20-18(21-22(17)19)12-14(2)15-9-10-15/h4-6,9-12,15H,1,7-8,13H2,2-3H3;2-7,11,13H,1,8-10H2;2-4,7-10,13H,1,5-6,11H2;2-7,11,15,23H,1,8-10,12H2;3-8,11,15H,2,9-10,12H2,1H3
InChIKeyJUOKZGVSKGBUQJ-UHFFFAOYSA-N
XLogP21.07
TPSA191.49 Ų
H-Bond Donors1
H-Bond Acceptors17
Rotatable Bonds22
Heavy Atoms121
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001627.90
LogP ≤ 521.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

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

Analyze 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine with MolForge

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Related Compounds

2-[4-[4-(hydroxymethyl)-2-(4-methyl-1,2,4-triazol-3-yl)phenyl]-6-[[2-methyl-3-[2-[[[4-[1-methyl-4-(4-methyl-1,2,4-triazol-3-yl)pyrazol-5-yl]-6-[3-oxo-7-(trifluoromethyl)-1H-isoindol-2-yl]-2-pyridinyl]amino]methyl]cyclopropyl]propyl]amino]-2-pyridinyl]-4-(trifluoromethyl)-3H-isoindol-1-one
CID 171515131
(4E)-4-[[5-(3-acetylphenyl)-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(3E)-3-[[5-[3-(aminomethyl)phenyl]-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(4E)-4-[[7-(cyclopropylamino)-5-[3-(1-hydroxyethyl)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;N-[[3-[7-(cyclopropylamino)-3-[(E)-(5-methylidene-2-oxopyrrolidin-3-ylidene)methyl]pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]methyl]acetamide;(3E)-3-[[7-(cyclopropylamino)-5-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one
CID 157406212
[7-(cyclohexylmethyl)-2-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-5-yl]-(2-methylazepan-1-yl)methanone;[2-[4-(dimethylamino)phenyl]-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidin-5-yl]-(2-methylazepan-1-yl)methanone;7-ethyl-2-(2-fluorophenyl)-N-hexan-2-yl-N-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide;[7-ethyl-2-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-5-yl]-(2-methylazocan-1-yl)methanone;[7-ethyl-2-[4-(hydroxymethyl)phenyl]pyrazolo[1,5-a]pyrimidin-5-yl]-(2-methylazepan-1-yl)methanone
CID 158851984

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine (CID 159028419) is 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine is C=C(Cc1nc2cccc(-c3ccc(C(=O)N(C)C)cc3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3ccc(C(F)(F)F)cc3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3cccc(C(F)(F)F)c3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3cccc(C)c3)n2n1)C1CC1.C=C(Cc1nc2cccc(-c3cccc(CO)c3)n2n1)C1CC1.
What is the InChIKey of 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is JUOKZGVSKGBUQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O.2C19H16F3N3.C19H19N3O.C19H19N3/c1-14(15-7-8-15)13-19-22-20-6-4-5-18(25(20)23-19)16-9-11-17(12-10-16)21(26)24(2)3;1-12(13-8-9-13)10-17-23-18-7-3-6-16(25(18)24-17)14-4-2-5-15(11-14)19(20,21)22;1-12(13-5-6-13)11-17-23-18-4-2-3-16(25(18)24-17)14-7-9-15(10-8-14)19(20,21)22;1-13(15-8-9-15)10-18-20-19-7-3-6-17(22(19)21-18)16-5-2-4-14(11-16)12-23;1-13-5-3-6-16(11-13)17-7-4-8-19-20-18(21-22(17)19)12-14(2)15-9-10-15/h4-6,9-12,15H,1,7-8,13H2,2-3H3;2-7,11,13H,1,8-10H2;2-4,7-10,13H,1,5-6,11H2;2-7,11,15,23H,1,8-10,12H2;3-8,11,15H,2,9-10,12H2,1H3.
What are the key properties of 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine?
2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 1627.90 g/mol, XLogP of 21.07, 22 rotatable bonds, 1 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylprop-2-enyl)-5-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine;4-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N,N-dimethylbenzamide;[3-[2-(2-cyclopropylprop-2-enyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenyl]methanol;2-(2-cyclopropylprop-2-enyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine;2-(2-cyclopropylprop-2-enyl)-5-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 159028419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).