N-quinolin-2-ylcyclohexanecarboxamide

C16H18N2O — CID 2812969

IUPACN-quinolin-2-ylcyclohexanecarboxamide
SMILESO=C(Nc1ccc2ccccc2n1)C1CCCCC1
InChIInChI=1S/C16H18N2O/c19-16(13-7-2-1-3-8-13)18-15-11-10-12-6-4-5-9-14(12)17-15/h4-6,9-11,13H,1-3,7-8H2,(H,17,18,19)
InChIKeyDHFLYUQFYGRMEU-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.75
Rot. Bonds2

About N-quinolin-2-ylcyclohexanecarboxamide

N-quinolin-2-ylcyclohexanecarboxamide (PubChem CID 2812969) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-quinolin-2-ylcyclohexanecarboxamide.

Molecular Properties

Compound NameN-quinolin-2-ylcyclohexanecarboxamide
PubChem CID2812969
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-quinolin-2-ylcyclohexanecarboxamide
SMILESO=C(Nc1ccc2ccccc2n1)C1CCCCC1
InChIInChI=1S/C16H18N2O/c19-16(13-7-2-1-3-8-13)18-15-11-10-12-6-4-5-9-14(12)17-15/h4-6,9-11,13H,1-3,7-8H2,(H,17,18,19)
InChIKeyDHFLYUQFYGRMEU-UHFFFAOYSA-N
XLogP3.75
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 ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclohexanecarboxamide, N-(2-((3,4-dichlorophenyl)amino)-4-quinolinyl)-
CID 25191023
1-[2-(Dimethylamino)quinolin-4-yl]-3-phenylurea
CID 2824465
N-[4-methyl-2-(4-morpholinyl)-6-quinolinyl]cyclohexanecarboxamide
CID 5067281
1-(2-(Diethylamino)quinazolin-4-yl)-3-phenylurea
CID 10640536
N-(2,6-diphenylpyrimidin-4-yl)isobutyramide
CID 11313151
N-(2,6-diphenylpyrimidin-4-yl)butyramide
CID 11359018
N-(2,6-diphenylpyrimidin-4-yl)-2-ethylbutyramide
CID 11371386
N-(2,6-Diphenylpyrimidin-4-YL)-2-methylbutanamide
CID 11427528
N-(2,6-diphenylpyrimidin-4-yl)propionamide
CID 11438116
N-(2,6-diphenylpyrimidin-4-yl)-3-methylbutyramide
CID 11739042
3-[2-Amino-6-(2-Methylphenyl)quinolin-3-Yl]-N-Cyclohexylpropanamide
CID 53236890
3-[2-amino-6-(2-methylphenyl)quinolin-3-yl]-N-(3,3-dimethylbutyl)propanamide
CID 53236891

Frequently Asked Questions

What is the IUPAC name of N-quinolin-2-ylcyclohexanecarboxamide?
The IUPAC name of N-quinolin-2-ylcyclohexanecarboxamide (CID 2812969) is N-quinolin-2-ylcyclohexanecarboxamide.
What is the SMILES notation for N-quinolin-2-ylcyclohexanecarboxamide?
The canonical SMILES for N-quinolin-2-ylcyclohexanecarboxamide is O=C(Nc1ccc2ccccc2n1)C1CCCCC1.
What is the InChIKey of N-quinolin-2-ylcyclohexanecarboxamide?
The InChIKey is DHFLYUQFYGRMEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c19-16(13-7-2-1-3-8-13)18-15-11-10-12-6-4-5-9-14(12)17-15/h4-6,9-11,13H,1-3,7-8H2,(H,17,18,19).
What are the key properties of N-quinolin-2-ylcyclohexanecarboxamide?
N-quinolin-2-ylcyclohexanecarboxamide has a molecular weight of 254.33 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinolin-2-ylcyclohexanecarboxamide is sourced from PubChem (CID 2812969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).