N-cyclopentyl-2-methylquinoline-4-carboxamide

C16H18N2O — CID 757639

IUPACN-cyclopentyl-2-methylquinoline-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCC2)c2ccccc2n1
InChIInChI=1S/C16H18N2O/c1-11-10-14(13-8-4-5-9-15(13)17-11)16(19)18-12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7H2,1H3,(H,18,19)
InChIKeyQUZJWFNAUJTZHU-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.22
Rot. Bonds2

About N-cyclopentyl-2-methylquinoline-4-carboxamide

N-cyclopentyl-2-methylquinoline-4-carboxamide (PubChem CID 757639) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-cyclopentyl-2-methylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methylquinoline-4-carboxamide
PubChem CID757639
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-cyclopentyl-2-methylquinoline-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCC2)c2ccccc2n1
InChIInChI=1S/C16H18N2O/c1-11-10-14(13-8-4-5-9-15(13)17-11)16(19)18-12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7H2,1H3,(H,18,19)
InChIKeyQUZJWFNAUJTZHU-UHFFFAOYSA-N
XLogP3.22
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methylquinoline-4-carboxamide?
The IUPAC name of N-cyclopentyl-2-methylquinoline-4-carboxamide (CID 757639) is N-cyclopentyl-2-methylquinoline-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-methylquinoline-4-carboxamide?
The canonical SMILES for N-cyclopentyl-2-methylquinoline-4-carboxamide is Cc1cc(C(=O)NC2CCCC2)c2ccccc2n1.
What is the InChIKey of N-cyclopentyl-2-methylquinoline-4-carboxamide?
The InChIKey is QUZJWFNAUJTZHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-11-10-14(13-8-4-5-9-15(13)17-11)16(19)18-12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7H2,1H3,(H,18,19).
What are the key properties of N-cyclopentyl-2-methylquinoline-4-carboxamide?
N-cyclopentyl-2-methylquinoline-4-carboxamide has a molecular weight of 254.33 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methylquinoline-4-carboxamide is sourced from PubChem (CID 757639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).