4-chloro-N-pyridin-3-ylquinoline-2-carboxamide

C15H10ClN3O — CID 63376160

IUPAC4-chloro-N-pyridin-3-ylquinoline-2-carboxamide
SMILESO=C(Nc1cccnc1)c1cc(Cl)c2ccccc2n1
InChIInChI=1S/C15H10ClN3O/c16-12-8-14(19-13-6-2-1-5-11(12)13)15(20)18-10-4-3-7-17-9-10/h1-9H,(H,18,20)
InChIKeyATZCENSXUVUESS-UHFFFAOYSA-N
MW283.72 g/mol
LogP3.54
Rot. Bonds2

About 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide

4-chloro-N-pyridin-3-ylquinoline-2-carboxamide (PubChem CID 63376160) has the molecular formula C15H10ClN3O and a molecular weight of 283.72 g/mol. Its IUPAC name is 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-pyridin-3-ylquinoline-2-carboxamide
PubChem CID63376160
Molecular FormulaC15H10ClN3O
Molecular Weight283.72 g/mol
Exact Mass283.05
IUPAC Name4-chloro-N-pyridin-3-ylquinoline-2-carboxamide
SMILESO=C(Nc1cccnc1)c1cc(Cl)c2ccccc2n1
InChIInChI=1S/C15H10ClN3O/c16-12-8-14(19-13-6-2-1-5-11(12)13)15(20)18-10-4-3-7-17-9-10/h1-9H,(H,18,20)
InChIKeyATZCENSXUVUESS-UHFFFAOYSA-N
XLogP3.54
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.72
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(3-iodophenyl)quinoline-2-carboxamide
CID 63483680
2-N,4-N,6-N-tripyridin-3-ylpyrimidine-2,4,6-tricarboxamide
CID 144765692
2-chloro-5-hydroxy-N-pyridin-3-ylbenzamide
CID 106501191
2-cyclopropyl-N-pyridin-3-ylquinoline-4-carboxamide
CID 31745720
2-N,9-N-dipyridin-3-yl-1,10-phenanthroline-2,9-dicarboxamide
CID 155927483
7-fluoro-N-pyridin-3-ylquinoline-2-carboxamide
CID 110485373
N-pyridin-3-ylbenzamide;dihydrochloride
CID 174671785
3,5-dichloro-N-pyridin-3-ylbenzamide
CID 1245821
N-(2-acetamidoethyl)-4-chloroquinoline-2-carboxamide
CID 63375771
4-chloro-N-(3-ethylpentan-3-yl)quinoline-2-carboxamide
CID 65038366
2-[(4-chloroquinoline-2-carbonyl)amino]oxyacetic acid
CID 63914484
1-[[(4-chloroquinoline-2-carbonyl)amino]methyl]cyclopropane-1-carboxylic acid
CID 115449917

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide?
The IUPAC name of 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide (CID 63376160) is 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide.
What is the SMILES notation for 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide?
The canonical SMILES for 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide is O=C(Nc1cccnc1)c1cc(Cl)c2ccccc2n1.
What is the InChIKey of 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide?
The InChIKey is ATZCENSXUVUESS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3O/c16-12-8-14(19-13-6-2-1-5-11(12)13)15(20)18-10-4-3-7-17-9-10/h1-9H,(H,18,20).
What are the key properties of 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide?
4-chloro-N-pyridin-3-ylquinoline-2-carboxamide has a molecular weight of 283.72 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-pyridin-3-ylquinoline-2-carboxamide is sourced from PubChem (CID 63376160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).