2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide

C14H13N5O — CID 62160962

IUPAC2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide
SMILESCn1ccc(NC(=O)c2cc(N)nc3ccccc23)n1
InChIInChI=1S/C14H13N5O/c1-19-7-6-13(18-19)17-14(20)10-8-12(15)16-11-5-3-2-4-9(10)11/h2-8H,1H3,(H2,15,16)(H,17,18,20)
InChIKeyGUGXZTSUFHJIAM-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.80
Rot. Bonds2

About 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide

2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide (PubChem CID 62160962) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide
PubChem CID62160962
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC Name2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide
SMILESCn1ccc(NC(=O)c2cc(N)nc3ccccc23)n1
InChIInChI=1S/C14H13N5O/c1-19-7-6-13(18-19)17-14(20)10-8-12(15)16-11-5-3-2-4-9(10)11/h2-8H,1H3,(H2,15,16)(H,17,18,20)
InChIKeyGUGXZTSUFHJIAM-UHFFFAOYSA-N
XLogP1.80
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-(2-methylphenyl)quinoline-4-carboxamide
CID 62154395
2-amino-N-tert-butylquinoline-4-carboxamide
CID 62156554
2-amino-N-(2-chlorophenyl)quinoline-4-carboxamide
CID 62155570
5-amino-2-methoxy-N-(1-methylpyrazol-3-yl)benzamide
CID 61104250
2-amino-N-(1H-pyrazol-4-yl)quinoline-4-carboxamide
CID 62154124
N-(1-methylpyrazol-3-yl)-1-benzofuran-2-carboxamide
CID 27148287
5-amino-2-methyl-N-(1-methylpyrazol-3-yl)pyridine-3-carboxamide
CID 54917547
2-amino-N-hexan-3-ylquinoline-4-carboxamide
CID 62160815
2-amino-N-(1-methylsulfonylpropan-2-yl)quinoline-4-carboxamide
CID 64643078
2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide
CID 166205807
5-bromo-2-methyl-N-(1-methylpyrazol-3-yl)benzamide
CID 65307280
2-amino-N-(2-methylsulfonylethyl)quinoline-4-carboxamide
CID 62152474

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide?
The IUPAC name of 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide (CID 62160962) is 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide.
What is the SMILES notation for 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide?
The canonical SMILES for 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide is Cn1ccc(NC(=O)c2cc(N)nc3ccccc23)n1.
What is the InChIKey of 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide?
The InChIKey is GUGXZTSUFHJIAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-19-7-6-13(18-19)17-14(20)10-8-12(15)16-11-5-3-2-4-9(10)11/h2-8H,1H3,(H2,15,16)(H,17,18,20).
What are the key properties of 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide?
2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-methylpyrazol-3-yl)quinoline-4-carboxamide is sourced from PubChem (CID 62160962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).