N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide

C9H7ClN4O — CID 43583033

IUPACN-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cn1)c1cn[nH]c1
InChIInChI=1S/C9H7ClN4O/c10-7-1-2-8(11-5-7)14-9(15)6-3-12-13-4-6/h1-5H,(H,12,13)(H,11,14,15)
InChIKeyKLKUEZBUBVQDQC-UHFFFAOYSA-N
MW222.64 g/mol
LogP1.71
Rot. Bonds2

About N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide

N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide (PubChem CID 43583033) has the molecular formula C9H7ClN4O and a molecular weight of 222.64 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide
PubChem CID43583033
Molecular FormulaC9H7ClN4O
Molecular Weight222.64 g/mol
Exact Mass222.03
IUPAC NameN-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cn1)c1cn[nH]c1
InChIInChI=1S/C9H7ClN4O/c10-7-1-2-8(11-5-7)14-9(15)6-3-12-13-4-6/h1-5H,(H,12,13)(H,11,14,15)
InChIKeyKLKUEZBUBVQDQC-UHFFFAOYSA-N
XLogP1.71
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.64
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N,6-N-bis(5-chloro-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 3421113
N-(2,5-dichlorophenyl)-1H-pyrazole-4-carboxamide
CID 43582385
N-(5-chloro-2-pyridinyl)-3,4,5-trimethoxybenzamide
CID 673854
4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055
N-(5-chloro-2-pyridinyl)-4-propan-2-yloxybenzamide
CID 33327699
N-(3-chloro-4-fluorophenyl)-1H-pyrazole-4-carboxamide
CID 43532923
N-(5-chloro-2-pyridinyl)-3-methoxy-4-methylbenzamide
CID 47122719
5-chloro-N-(5-chloro-2-pyridinyl)-2-hydrazinylbenzamide
CID 55051225
N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide
CID 104640066
3-benzamido-N-(5-chloro-2-pyridinyl)benzamide
CID 3929829
N-(5-chloro-2-pyridinyl)-4-(propanoylamino)benzamide
CID 2988082
3-acetamido-N-(5-chloro-2-pyridinyl)benzamide
CID 13177093

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide (CID 43583033) is N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide is O=C(Nc1ccc(Cl)cn1)c1cn[nH]c1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide?
The InChIKey is KLKUEZBUBVQDQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN4O/c10-7-1-2-8(11-5-7)14-9(15)6-3-12-13-4-6/h1-5H,(H,12,13)(H,11,14,15).
What are the key properties of N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide?
N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide has a molecular weight of 222.64 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 43583033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).