6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C14H17ClN4O — CID 82557364

IUPAC6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1ccc(C2Cn3nc(N)nc3CC2C)cc1Cl
InChIInChI=1S/C14H17ClN4O/c1-8-5-13-17-14(16)18-19(13)7-10(8)9-3-4-12(20-2)11(15)6-9/h3-4,6,8,10H,5,7H2,1-2H3,(H2,16,18)
InChIKeyOEYUUIRRFLUIHV-UHFFFAOYSA-N
MW292.77 g/mol
LogP2.50
Rot. Bonds2

About 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine

6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 82557364) has the molecular formula C14H17ClN4O and a molecular weight of 292.77 g/mol. Its IUPAC name is 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID82557364
Molecular FormulaC14H17ClN4O
Molecular Weight292.77 g/mol
Exact Mass292.11
IUPAC Name6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1ccc(C2Cn3nc(N)nc3CC2C)cc1Cl
InChIInChI=1S/C14H17ClN4O/c1-8-5-13-17-14(16)18-19(13)7-10(8)9-3-4-12(20-2)11(15)6-9/h3-4,6,8,10H,5,7H2,1-2H3,(H2,16,18)
InChIKeyOEYUUIRRFLUIHV-UHFFFAOYSA-N
XLogP2.50
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine with MolForge

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Related Compounds

6-(3-fluorophenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 82557324
2-(2-amino-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)phenol
CID 82557330
1-[2-(3-chloro-4-methoxyphenyl)cyclopropyl]ethanamine
CID 65022463
6-(2-methoxy-5-methylphenyl)-5-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 82557409
(5R,7R)-5-(3,4-dichlorophenyl)-7-(3,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
CID 1085818
7-(3,4-dimethylphenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 82557056
5-(6-fluoro-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methoxyaniline
CID 83966817
5-(5-chloro-2-methoxyphenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 82557228
5-(3-chloro-4-methoxyphenyl)cyclohexane-1,3-dione
CID 81340530
4-(3-chloro-4-methoxyphenyl)-1-methylpiperidine
CID 156561113
5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine
CID 79521731
2-(3-chloro-4-methoxyphenyl)cyclohexane-1-carbonitrile
CID 82244801

Frequently Asked Questions

What is the IUPAC name of 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 82557364) is 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine is COc1ccc(C2Cn3nc(N)nc3CC2C)cc1Cl.
What is the InChIKey of 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is OEYUUIRRFLUIHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4O/c1-8-5-13-17-14(16)18-19(13)7-10(8)9-3-4-12(20-2)11(15)6-9/h3-4,6,8,10H,5,7H2,1-2H3,(H2,16,18).
What are the key properties of 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 292.77 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chloro-4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 82557364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).