N-quinolin-3-yl-1H-pyrazole-5-carboxamide

C13H10N4O — CID 11651620

IUPACN-quinolin-3-yl-1H-pyrazole-5-carboxamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccn[nH]1
InChIInChI=1S/C13H10N4O/c18-13(12-5-6-15-17-12)16-10-7-9-3-1-2-4-11(9)14-8-10/h1-8H,(H,15,17)(H,16,18)
InChIKeyFRGGNYZSGBQZNS-UHFFFAOYSA-N
MW238.25 g/mol
LogP2.21
Rot. Bonds2

About N-quinolin-3-yl-1H-pyrazole-5-carboxamide

N-quinolin-3-yl-1H-pyrazole-5-carboxamide (PubChem CID 11651620) has the molecular formula C13H10N4O and a molecular weight of 238.25 g/mol. Its IUPAC name is N-quinolin-3-yl-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-quinolin-3-yl-1H-pyrazole-5-carboxamide
PubChem CID11651620
Molecular FormulaC13H10N4O
Molecular Weight238.25 g/mol
Exact Mass238.09
IUPAC NameN-quinolin-3-yl-1H-pyrazole-5-carboxamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccn[nH]1
InChIInChI=1S/C13H10N4O/c18-13(12-5-6-15-17-12)16-10-7-9-3-1-2-4-11(9)14-8-10/h1-8H,(H,15,17)(H,16,18)
InChIKeyFRGGNYZSGBQZNS-UHFFFAOYSA-N
XLogP2.21
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-Fluoro-5-[[3-[(1E)-2-(2-pyridinyl)ethenyl]-1H-indazol-6-yl]amino]phenyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
CID 9934283
N-(4-((3-(prop-2-enoylamino)benzoyl)amino)phenyl)-6-(1H-pyrazol-5-yl)pyridine-2-carboxamide
CID 131704492
N-(6-methyl-3-pyridinyl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89458694
3-Ethyl-4-methyl-N'-(4-pyridinylmethylene)-1H-pyrazole-5-carbohydrazide
CID 6872295
N-(5-methyl-3-pyridinyl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381061
8-[4-(1-Methylpyrazol-4-yl)phenyl]-1,6-naphthyridine-2-carboxamide
CID 118660845
US10022354, Example 69
CID 121279703
3-methyl-N'-(4-pyridinylmethylene)-1H-pyrazole-5-carbohydrazide
CID 6871425
4-bromo-N'-[(2-chloro-3-quinolinyl)methylene]-1-methyl-1H-pyrazole-3-carbohydrazide
CID 9618022
N-(2-methylphenyl)pyrazolo[1,5-a]pyridine-2-carboxamide
CID 16193925
N'-[(E)-1H-indol-3-ylmethylidene]-1H-pyrazole-3-carbohydrazide
CID 135510250
(E)-N'-((1H-indol-3-yl)methylene)-3-isopropyl-1H-pyrazole-5-carbohydrazide
CID 135642422

Frequently Asked Questions

What is the IUPAC name of N-quinolin-3-yl-1H-pyrazole-5-carboxamide?
The IUPAC name of N-quinolin-3-yl-1H-pyrazole-5-carboxamide (CID 11651620) is N-quinolin-3-yl-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-quinolin-3-yl-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-quinolin-3-yl-1H-pyrazole-5-carboxamide is O=C(Nc1cnc2ccccc2c1)c1ccn[nH]1.
What is the InChIKey of N-quinolin-3-yl-1H-pyrazole-5-carboxamide?
The InChIKey is FRGGNYZSGBQZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O/c18-13(12-5-6-15-17-12)16-10-7-9-3-1-2-4-11(9)14-8-10/h1-8H,(H,15,17)(H,16,18).
What are the key properties of N-quinolin-3-yl-1H-pyrazole-5-carboxamide?
N-quinolin-3-yl-1H-pyrazole-5-carboxamide has a molecular weight of 238.25 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinolin-3-yl-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 11651620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).