2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid

C15H20N4O2 — CID 61015652

IUPAC2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid
SMILESCc1cc(NC(C(=O)O)C2CCCCC2)n2ncnc2c1
InChIInChI=1S/C15H20N4O2/c1-10-7-12-16-9-17-19(12)13(8-10)18-14(15(20)21)11-5-3-2-4-6-11/h7-9,11,14,18H,2-6H2,1H3,(H,20,21)
InChIKeyWXUMTGLZMLCAEF-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.48
Rot. Bonds4

About 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid

2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid (PubChem CID 61015652) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid.

Molecular Properties

Compound Name2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid
PubChem CID61015652
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid
SMILESCc1cc(NC(C(=O)O)C2CCCCC2)n2ncnc2c1
InChIInChI=1S/C15H20N4O2/c1-10-7-12-16-9-17-19(12)13(8-10)18-14(15(20)21)11-5-3-2-4-6-11/h7-9,11,14,18H,2-6H2,1H3,(H,20,21)
InChIKeyWXUMTGLZMLCAEF-UHFFFAOYSA-N
XLogP2.48
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid?
The IUPAC name of 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid (CID 61015652) is 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid.
What is the SMILES notation for 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid?
The canonical SMILES for 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid is Cc1cc(NC(C(=O)O)C2CCCCC2)n2ncnc2c1.
What is the InChIKey of 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid?
The InChIKey is WXUMTGLZMLCAEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-10-7-12-16-9-17-19(12)13(8-10)18-14(15(20)21)11-5-3-2-4-6-11/h7-9,11,14,18H,2-6H2,1H3,(H,20,21).
What are the key properties of 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid?
2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid has a molecular weight of 288.35 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]acetic acid is sourced from PubChem (CID 61015652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).