2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide

C14H13N5O — CID 62112556

IUPAC2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide
SMILESNc1ccn(CC(=O)Nc2cnc3ccccc3c2)n1
InChIInChI=1S/C14H13N5O/c15-13-5-6-19(18-13)9-14(20)17-11-7-10-3-1-2-4-12(10)16-8-11/h1-8H,9H2,(H2,15,18)(H,17,20)
InChIKeyZCVJZIPJZIRGOT-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.65
Rot. Bonds3

About 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide

2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide (PubChem CID 62112556) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide
PubChem CID62112556
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC Name2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide
SMILESNc1ccn(CC(=O)Nc2cnc3ccccc3c2)n1
InChIInChI=1S/C14H13N5O/c15-13-5-6-19(18-13)9-14(20)17-11-7-10-3-1-2-4-12(10)16-8-11/h1-8H,9H2,(H2,15,18)(H,17,20)
InChIKeyZCVJZIPJZIRGOT-UHFFFAOYSA-N
XLogP1.65
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-aminopyrazol-1-yl)-N-(3-chlorophenyl)acetamide
CID 60783120
4-oxo-4-(quinolin-3-ylamino)butanoic acid
CID 861757
2-(3-aminopyrazol-1-yl)-N-[4-(dimethylamino)phenyl]acetamide
CID 62102860
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-quinolin-3-ylacetamide
CID 78839406
2-(1,4-diazepan-1-yl)-N-quinolin-3-ylacetamide
CID 62838988
2-(3-aminopyrazol-1-yl)-N-(4-methylsulfanylphenyl)acetamide
CID 62102213
2-[2-oxo-2-(quinolin-3-ylamino)ethoxy]acetic acid
CID 61329390
3-amino-N-quinolin-3-yl-1H-pyrazole-5-carboxamide
CID 64523845
6-amino-N-quinolin-3-ylpyridine-2-carboxamide
CID 62805980
2-(3-aminopyrazol-1-yl)-N-(3-cyano-4-fluorophenyl)acetamide
CID 62316767
1-methyl-1-phenyl-3-quinolin-3-ylurea
CID 886905
2-(3-aminopyrazol-1-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 63819555

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide (CID 62112556) is 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide is Nc1ccn(CC(=O)Nc2cnc3ccccc3c2)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide?
The InChIKey is ZCVJZIPJZIRGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c15-13-5-6-19(18-13)9-14(20)17-11-7-10-3-1-2-4-12(10)16-8-11/h1-8H,9H2,(H2,15,18)(H,17,20).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide?
2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide has a molecular weight of 267.29 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-quinolin-3-ylacetamide is sourced from PubChem (CID 62112556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).