2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide

C12H10ClN3O — CID 62154696

IUPAC2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2ccc(Cl)cc2)ccn1
InChIInChI=1S/C12H10ClN3O/c13-9-1-3-10(4-2-9)16-12(17)8-5-6-15-11(14)7-8/h1-7H,(H2,14,15)(H,16,17)
InChIKeyXTIJBYTXMFDEJB-UHFFFAOYSA-N
MW247.69 g/mol
LogP2.57
Rot. Bonds2

About 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide

2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide (PubChem CID 62154696) has the molecular formula C12H10ClN3O and a molecular weight of 247.69 g/mol. Its IUPAC name is 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide
PubChem CID62154696
Molecular FormulaC12H10ClN3O
Molecular Weight247.69 g/mol
Exact Mass247.05
IUPAC Name2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2ccc(Cl)cc2)ccn1
InChIInChI=1S/C12H10ClN3O/c13-9-1-3-10(4-2-9)16-12(17)8-5-6-15-11(14)7-8/h1-7H,(H2,14,15)(H,16,17)
InChIKeyXTIJBYTXMFDEJB-UHFFFAOYSA-N
XLogP2.57
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.69
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide
CID 63180905
2-amino-N-(4-fluoro-3-methoxyphenyl)pyridine-4-carboxamide
CID 114840722
2-amino-N-(3-chloro-4-methoxyphenyl)pyridine-4-carboxamide
CID 55043717
2-amino-N-(4-chloro-3-nitrophenyl)pyridine-4-carboxamide
CID 107812124
2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide
CID 110862205
2-amino-N-(1H-pyrazol-4-yl)pyridine-4-carboxamide
CID 62154464
4-N-(4-chlorophenyl)-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109092487
4-N-(4-chlorophenyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092859
2-amino-N-(2,3,4-trifluorophenyl)pyridine-4-carboxamide
CID 62151990
2-N-(4-chlorophenyl)-4-N-[4-(dimethylamino)phenyl]pyridine-2,4-dicarboxamide
CID 109092885
3-amino-N-(4-chlorophenyl)-4-fluorobenzamide
CID 39364346
2-amino-N-(5-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 107586635

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide (CID 62154696) is 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide is Nc1cc(C(=O)Nc2ccc(Cl)cc2)ccn1.
What is the InChIKey of 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide?
The InChIKey is XTIJBYTXMFDEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O/c13-9-1-3-10(4-2-9)16-12(17)8-5-6-15-11(14)7-8/h1-7H,(H2,14,15)(H,16,17).
What are the key properties of 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide?
2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide has a molecular weight of 247.69 g/mol, XLogP of 2.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 62154696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).