N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide

C10H8ClN3O2 — CID 110600652

IUPACN-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1cc(=O)[nH][nH]1
InChIInChI=1S/C10H8ClN3O2/c11-6-3-1-2-4-7(6)12-10(16)8-5-9(15)14-13-8/h1-5H,(H,12,16)(H2,13,14,15)
InChIKeyOGVMSKGXHKPXSR-UHFFFAOYSA-N
MW237.65 g/mol
LogP1.61
Rot. Bonds2

About N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide

N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide (PubChem CID 110600652) has the molecular formula C10H8ClN3O2 and a molecular weight of 237.65 g/mol. Its IUPAC name is N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide
PubChem CID110600652
Molecular FormulaC10H8ClN3O2
Molecular Weight237.65 g/mol
Exact Mass237.03
IUPAC NameN-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1cc(=O)[nH][nH]1
InChIInChI=1S/C10H8ClN3O2/c11-6-3-1-2-4-7(6)12-10(16)8-5-9(15)14-13-8/h1-5H,(H,12,16)(H2,13,14,15)
InChIKeyOGVMSKGXHKPXSR-UHFFFAOYSA-N
XLogP1.61
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.65
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-methylphenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide
CID 112513869
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CID 110600737
N-(2-chlorophenyl)-2-hydrazinylbenzamide
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N-(2-chlorophenyl)-3-pyridin-4-yl-1H-pyrazole-5-carboxamide
CID 53008238
4-amino-3,5-dichloro-N-(2-chlorophenyl)benzamide
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N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride
CID 110756414
N-(2-chlorophenyl)-4,6-dimethyl-1H-indole-2-carboxamide
CID 2742882
N-(2-chlorophenyl)-2-iodobenzamide
CID 1105942
N-(2-chlorophenyl)-2-sulfanylacetamide
CID 679489
N-(2-chlorophenyl)-3-methylbenzamide
CID 675649
N-(2-chlorophenyl)-1-oxoisothiochromene-3-carboxamide
CID 17015288
N-(2-chlorophenyl)-3-(2-hydroxy-5-methylphenyl)-1H-pyrazole-5-carboxamide
CID 2039802

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide (CID 110600652) is N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide is O=C(Nc1ccccc1Cl)c1cc(=O)[nH][nH]1.
What is the InChIKey of N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide?
The InChIKey is OGVMSKGXHKPXSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3O2/c11-6-3-1-2-4-7(6)12-10(16)8-5-9(15)14-13-8/h1-5H,(H,12,16)(H2,13,14,15).
What are the key properties of N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide?
N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide has a molecular weight of 237.65 g/mol, XLogP of 1.61, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide is sourced from PubChem (CID 110600652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).