N-cyclohexyl-2-methylquinoline-5-carboxamide

C17H20N2O — CID 143116109

IUPACN-cyclohexyl-2-methylquinoline-5-carboxamide
SMILESCc1ccc2c(C(=O)NC3CCCCC3)cccc2n1
InChIInChI=1S/C17H20N2O/c1-12-10-11-14-15(8-5-9-16(14)18-12)17(20)19-13-6-3-2-4-7-13/h5,8-11,13H,2-4,6-7H2,1H3,(H,19,20)
InChIKeyDLZUXWHRTLVBRP-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.61
Rot. Bonds2

About N-cyclohexyl-2-methylquinoline-5-carboxamide

N-cyclohexyl-2-methylquinoline-5-carboxamide (PubChem CID 143116109) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-cyclohexyl-2-methylquinoline-5-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-methylquinoline-5-carboxamide
PubChem CID143116109
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-cyclohexyl-2-methylquinoline-5-carboxamide
SMILESCc1ccc2c(C(=O)NC3CCCCC3)cccc2n1
InChIInChI=1S/C17H20N2O/c1-12-10-11-14-15(8-5-9-16(14)18-12)17(20)19-13-6-3-2-4-7-13/h5,8-11,13H,2-4,6-7H2,1H3,(H,19,20)
InChIKeyDLZUXWHRTLVBRP-UHFFFAOYSA-N
XLogP3.61
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-7-fluoro-2-methylquinoline-4-carboxamide
CID 46409117
N-(azepan-4-yl)-2-methylquinoline-4-carboxamide
CID 105058000
N-cyclohexylpyrene-1-carboxamide
CID 15111774
N-cycloheptyl-2-methylquinazoline-4-carboxamide
CID 110702850
N-cycloheptyl-2-fluoro-3-methylbenzamide
CID 80719060
N-cyclohexyl-2-methylpyridine-3-carboxamide
CID 78951017
N-cyclohexyl-2-(3,5-dimethylanilino)quinoline-4-carboxamide
CID 15990902
2-[3-(cyclohexylcarbamoyl)-2-methylphenyl]acetic acid
CID 121005204
N-cyclopentyl-3-hydroxy-2-methylbenzamide
CID 82786265
N-cyclopentyl-2-(2,4-dimethylphenyl)quinoline-4-carboxamide
CID 3667431
N-cyclohexyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 757634
2-[2-(cyclohexylcarbamoyl)phenyl]acetic acid
CID 114199766

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-methylquinoline-5-carboxamide?
The IUPAC name of N-cyclohexyl-2-methylquinoline-5-carboxamide (CID 143116109) is N-cyclohexyl-2-methylquinoline-5-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-methylquinoline-5-carboxamide?
The canonical SMILES for N-cyclohexyl-2-methylquinoline-5-carboxamide is Cc1ccc2c(C(=O)NC3CCCCC3)cccc2n1.
What is the InChIKey of N-cyclohexyl-2-methylquinoline-5-carboxamide?
The InChIKey is DLZUXWHRTLVBRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-10-11-14-15(8-5-9-16(14)18-12)17(20)19-13-6-3-2-4-7-13/h5,8-11,13H,2-4,6-7H2,1H3,(H,19,20).
What are the key properties of N-cyclohexyl-2-methylquinoline-5-carboxamide?
N-cyclohexyl-2-methylquinoline-5-carboxamide has a molecular weight of 268.36 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-methylquinoline-5-carboxamide is sourced from PubChem (CID 143116109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).