6-chloro-N-ethenylquinoline-2-carboxamide

C12H9ClN2O — CID 142528141

IUPAC6-chloro-N-ethenylquinoline-2-carboxamide
SMILESC=CNC(=O)c1ccc2cc(Cl)ccc2n1
InChIInChI=1S/C12H9ClN2O/c1-2-14-12(16)11-5-3-8-7-9(13)4-6-10(8)15-11/h2-7H,1H2,(H,14,16)
InChIKeyBUQPXKLSWLOEKG-UHFFFAOYSA-N
MW232.67 g/mol
LogP2.76
Rot. Bonds2

About 6-chloro-N-ethenylquinoline-2-carboxamide

6-chloro-N-ethenylquinoline-2-carboxamide (PubChem CID 142528141) has the molecular formula C12H9ClN2O and a molecular weight of 232.67 g/mol. Its IUPAC name is 6-chloro-N-ethenylquinoline-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-ethenylquinoline-2-carboxamide
PubChem CID142528141
Molecular FormulaC12H9ClN2O
Molecular Weight232.67 g/mol
Exact Mass232.04
IUPAC Name6-chloro-N-ethenylquinoline-2-carboxamide
SMILESC=CNC(=O)c1ccc2cc(Cl)ccc2n1
InChIInChI=1S/C12H9ClN2O/c1-2-14-12(16)11-5-3-8-7-9(13)4-6-10(8)15-11/h2-7H,1H2,(H,14,16)
InChIKeyBUQPXKLSWLOEKG-UHFFFAOYSA-N
XLogP2.76
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.67
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butan-2-yl-5-[3-(trifluoromethoxy)cyclobutyl]-1,3,4-oxadiazole;6-chloro-N-ethenylquinoline-2-carboxamide
CID 142528140
N-[4-(aminomethyl)cyclohexyl]-6-chloroquinoline-2-carboxamide
CID 155391375
[1-[(6-chloroquinoline-2-carbonyl)amino]piperidin-4-yl]methyl carbamate
CID 175221856
N-(5-chloro-2-methoxyphenyl)-6-methoxyquinoline-2-carboxamide
CID 33314112
N-(4-chloro-2-iodophenyl)quinoline-2-carboxamide
CID 107640561
N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide
CID 55369875
[3-[[(6-chloroquinoline-2-carbonyl)amino]methyl]cyclopentyl]carbamic acid
CID 155069060
N'-(5-chloro-2-fluorobenzoyl)quinoline-2-carbohydrazide
CID 35065860
[4-[(6-chloroquinoline-2-carbonyl)amino]piperidin-1-yl] 2,2,2-trifluoroacetate
CID 146506270
tert-butyl 4-[(6-chloroquinoline-2-carbonyl)amino]piperidine-1-carboxylate
CID 139512502
7-chloro-N-cyclopentylquinoline-2-carboxamide
CID 110490278
2-[(7-chloroquinoline-2-carbonyl)amino]propanoic acid
CID 110490256

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-ethenylquinoline-2-carboxamide?
The IUPAC name of 6-chloro-N-ethenylquinoline-2-carboxamide (CID 142528141) is 6-chloro-N-ethenylquinoline-2-carboxamide.
What is the SMILES notation for 6-chloro-N-ethenylquinoline-2-carboxamide?
The canonical SMILES for 6-chloro-N-ethenylquinoline-2-carboxamide is C=CNC(=O)c1ccc2cc(Cl)ccc2n1.
What is the InChIKey of 6-chloro-N-ethenylquinoline-2-carboxamide?
The InChIKey is BUQPXKLSWLOEKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O/c1-2-14-12(16)11-5-3-8-7-9(13)4-6-10(8)15-11/h2-7H,1H2,(H,14,16).
What are the key properties of 6-chloro-N-ethenylquinoline-2-carboxamide?
6-chloro-N-ethenylquinoline-2-carboxamide has a molecular weight of 232.67 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-ethenylquinoline-2-carboxamide is sourced from PubChem (CID 142528141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).