N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride

C12H10Cl2N2O — CID 110756414

IUPACN-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccccc1Cl)c1ccncc1
InChIInChI=1S/C12H9ClN2O.ClH/c13-10-3-1-2-4-11(10)15-12(16)9-5-7-14-8-6-9;/h1-8H,(H,15,16);1H
InChIKeyDMYHHTJSLJWEIZ-UHFFFAOYSA-N
MW269.13 g/mol
LogP3.41
Rot. Bonds2

About N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride

N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride (PubChem CID 110756414) has the molecular formula C12H10Cl2N2O and a molecular weight of 269.13 g/mol. Its IUPAC name is N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride
PubChem CID110756414
Molecular FormulaC12H10Cl2N2O
Molecular Weight269.13 g/mol
Exact Mass268.02
IUPAC NameN-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccccc1Cl)c1ccncc1
InChIInChI=1S/C12H9ClN2O.ClH/c13-10-3-1-2-4-11(10)15-12(16)9-5-7-14-8-6-9;/h1-8H,(H,15,16);1H
InChIKeyDMYHHTJSLJWEIZ-UHFFFAOYSA-N
XLogP3.41
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.13
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(2-bromophenyl)pyridine-4-carboxamide
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CID 109055210
4-chloro-3-(pyridine-4-carbonylamino)benzoic acid
CID 24688561
N-[2-(trifluoromethyl)phenyl]pyridine-4-carboxamide;hydrochloride
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N-[3-(2-chloroanilino)sulfanylphenyl]pyridine-4-carboxamide
CID 170976894
N-(2-methylsulfanylphenyl)pyridine-4-carboxamide
CID 1244343
N-(2-chlorophenyl)-3-hydroxypyridine-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride?
The IUPAC name of N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride (CID 110756414) is N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride is Cl.O=C(Nc1ccccc1Cl)c1ccncc1.
What is the InChIKey of N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride?
The InChIKey is DMYHHTJSLJWEIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O.ClH/c13-10-3-1-2-4-11(10)15-12(16)9-5-7-14-8-6-9;/h1-8H,(H,15,16);1H.
What are the key properties of N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride?
N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride has a molecular weight of 269.13 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride is sourced from PubChem (CID 110756414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).