4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide

C16H19N7O — CID 166361874

IUPAC4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCN(Cc1ccc2n[nH]nc2c1)C(=O)c1cc2n(n1)CCCC2N
InChIInChI=1S/C16H19N7O/c1-22(9-10-4-5-12-13(7-10)19-21-18-12)16(24)14-8-15-11(17)3-2-6-23(15)20-14/h4-5,7-8,11H,2-3,6,9,17H2,1H3,(H,18,19,21)
InChIKeyBSGNAYHEDCRRSU-UHFFFAOYSA-N
MW325.38 g/mol
LogP1.22
Rot. Bonds3

About 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide

4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide (PubChem CID 166361874) has the molecular formula C16H19N7O and a molecular weight of 325.38 g/mol. Its IUPAC name is 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
PubChem CID166361874
Molecular FormulaC16H19N7O
Molecular Weight325.38 g/mol
Exact Mass325.17
IUPAC Name4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCN(Cc1ccc2n[nH]nc2c1)C(=O)c1cc2n(n1)CCCC2N
InChIInChI=1S/C16H19N7O/c1-22(9-10-4-5-12-13(7-10)19-21-18-12)16(24)14-8-15-11(17)3-2-6-23(15)20-14/h4-5,7-8,11H,2-3,6,9,17H2,1H3,(H,18,19,21)
InChIKeyBSGNAYHEDCRRSU-UHFFFAOYSA-N
XLogP1.22
TPSA105.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.38
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide 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 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
The IUPAC name of 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide (CID 166361874) is 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide.
What is the SMILES notation for 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
The canonical SMILES for 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide is CN(Cc1ccc2n[nH]nc2c1)C(=O)c1cc2n(n1)CCCC2N.
What is the InChIKey of 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
The InChIKey is BSGNAYHEDCRRSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N7O/c1-22(9-10-4-5-12-13(7-10)19-21-18-12)16(24)14-8-15-11(17)3-2-6-23(15)20-14/h4-5,7-8,11H,2-3,6,9,17H2,1H3,(H,18,19,21).
What are the key properties of 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide?
4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide has a molecular weight of 325.38 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2H-benzotriazol-5-ylmethyl)-N-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2-carboxamide is sourced from PubChem (CID 166361874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).