7-chloro-N-cyclopentylquinoline-2-carboxamide

C15H15ClN2O — CID 110490278

IUPAC7-chloro-N-cyclopentylquinoline-2-carboxamide
SMILESO=C(NC1CCCC1)c1ccc2ccc(Cl)cc2n1
InChIInChI=1S/C15H15ClN2O/c16-11-7-5-10-6-8-13(18-14(10)9-11)15(19)17-12-3-1-2-4-12/h5-9,12H,1-4H2,(H,17,19)
InChIKeyDPMMKJTXDCIZOC-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.56
Rot. Bonds2

About 7-chloro-N-cyclopentylquinoline-2-carboxamide

7-chloro-N-cyclopentylquinoline-2-carboxamide (PubChem CID 110490278) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is 7-chloro-N-cyclopentylquinoline-2-carboxamide.

Molecular Properties

Compound Name7-chloro-N-cyclopentylquinoline-2-carboxamide
PubChem CID110490278
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC Name7-chloro-N-cyclopentylquinoline-2-carboxamide
SMILESO=C(NC1CCCC1)c1ccc2ccc(Cl)cc2n1
InChIInChI=1S/C15H15ClN2O/c16-11-7-5-10-6-8-13(18-14(10)9-11)15(19)17-12-3-1-2-4-12/h5-9,12H,1-4H2,(H,17,19)
InChIKeyDPMMKJTXDCIZOC-UHFFFAOYSA-N
XLogP3.56
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-cyclopentylquinoline-2-carboxamide?
The IUPAC name of 7-chloro-N-cyclopentylquinoline-2-carboxamide (CID 110490278) is 7-chloro-N-cyclopentylquinoline-2-carboxamide.
What is the SMILES notation for 7-chloro-N-cyclopentylquinoline-2-carboxamide?
The canonical SMILES for 7-chloro-N-cyclopentylquinoline-2-carboxamide is O=C(NC1CCCC1)c1ccc2ccc(Cl)cc2n1.
What is the InChIKey of 7-chloro-N-cyclopentylquinoline-2-carboxamide?
The InChIKey is DPMMKJTXDCIZOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c16-11-7-5-10-6-8-13(18-14(10)9-11)15(19)17-12-3-1-2-4-12/h5-9,12H,1-4H2,(H,17,19).
What are the key properties of 7-chloro-N-cyclopentylquinoline-2-carboxamide?
7-chloro-N-cyclopentylquinoline-2-carboxamide has a molecular weight of 274.75 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-cyclopentylquinoline-2-carboxamide is sourced from PubChem (CID 110490278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).