N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide

C14H15N7O — CID 91821160

IUPACN-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
SMILESCC(C)c1nc(NC(=O)c2cc(-c3ccccn3)n[nH]2)n[nH]1
InChIInChI=1S/C14H15N7O/c1-8(2)12-16-14(21-20-12)17-13(22)11-7-10(18-19-11)9-5-3-4-6-15-9/h3-8H,1-2H3,(H,18,19)(H2,16,17,20,21,22)
InChIKeyQPLMXXMMTPZZBQ-UHFFFAOYSA-N
MW297.32 g/mol
LogP1.97
Rot. Bonds4

About N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide

N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide (PubChem CID 91821160) has the molecular formula C14H15N7O and a molecular weight of 297.32 g/mol. Its IUPAC name is N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
PubChem CID91821160
Molecular FormulaC14H15N7O
Molecular Weight297.32 g/mol
Exact Mass297.13
IUPAC NameN-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
SMILESCC(C)c1nc(NC(=O)c2cc(-c3ccccn3)n[nH]2)n[nH]1
InChIInChI=1S/C14H15N7O/c1-8(2)12-16-14(21-20-12)17-13(22)11-7-10(18-19-11)9-5-3-4-6-15-9/h3-8H,1-2H3,(H,18,19)(H2,16,17,20,21,22)
InChIKeyQPLMXXMMTPZZBQ-UHFFFAOYSA-N
XLogP1.97
TPSA112.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 51.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-ethoxyphenyl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 22576776
N-(1-hydroxy-3-methylpentan-2-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 91821141
4-acetyl-N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-1H-pyrrole-2-carboxamide
CID 51107571
N-(3,4-dimethoxyphenyl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 46352005
N-(3-methylsulfanylphenyl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 22576795
N-(2-ethyl-3H-benzimidazol-5-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 46964446
N-(5-methyl-2-propylpyrazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 134703545
(2R)-2-methoxy-2-phenyl-N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)acetamide
CID 95330075
(2S)-2-methoxy-2-phenyl-N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)acetamide
CID 95330076
N-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 71701499
2-[4-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)carbamoyl]phenoxy]acetic acid
CID 167761393
N-(2-chloro-4,6-dimethoxyphenyl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 46352037

Frequently Asked Questions

What is the IUPAC name of N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide (CID 91821160) is N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide is CC(C)c1nc(NC(=O)c2cc(-c3ccccn3)n[nH]2)n[nH]1.
What is the InChIKey of N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide?
The InChIKey is QPLMXXMMTPZZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N7O/c1-8(2)12-16-14(21-20-12)17-13(22)11-7-10(18-19-11)9-5-3-4-6-15-9/h3-8H,1-2H3,(H,18,19)(H2,16,17,20,21,22).
What are the key properties of N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide?
N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide has a molecular weight of 297.32 g/mol, XLogP of 1.97, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 91821160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).