N-(1-quinolin-2-ylcyclohexyl)propanamide

C18H22N2O — CID 137371294

IUPACN-(1-quinolin-2-ylcyclohexyl)propanamide
SMILESCCC(=O)NC1(c2ccc3ccccc3n2)CCCCC1
InChIInChI=1S/C18H22N2O/c1-2-17(21)20-18(12-6-3-7-13-18)16-11-10-14-8-4-5-9-15(14)19-16/h4-5,8-11H,2-3,6-7,12-13H2,1H3,(H,20,21)
InChIKeyQIVKXZMSRMSTCN-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.92
Rot. Bonds3

About N-(1-quinolin-2-ylcyclohexyl)propanamide

N-(1-quinolin-2-ylcyclohexyl)propanamide (PubChem CID 137371294) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-(1-quinolin-2-ylcyclohexyl)propanamide.

Molecular Properties

Compound NameN-(1-quinolin-2-ylcyclohexyl)propanamide
PubChem CID137371294
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-(1-quinolin-2-ylcyclohexyl)propanamide
SMILESCCC(=O)NC1(c2ccc3ccccc3n2)CCCCC1
InChIInChI=1S/C18H22N2O/c1-2-17(21)20-18(12-6-3-7-13-18)16-11-10-14-8-4-5-9-15(14)19-16/h4-5,8-11H,2-3,6-7,12-13H2,1H3,(H,20,21)
InChIKeyQIVKXZMSRMSTCN-UHFFFAOYSA-N
XLogP3.92
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-quinolin-2-ylcyclohexyl)propanamide?
The IUPAC name of N-(1-quinolin-2-ylcyclohexyl)propanamide (CID 137371294) is N-(1-quinolin-2-ylcyclohexyl)propanamide.
What is the SMILES notation for N-(1-quinolin-2-ylcyclohexyl)propanamide?
The canonical SMILES for N-(1-quinolin-2-ylcyclohexyl)propanamide is CCC(=O)NC1(c2ccc3ccccc3n2)CCCCC1.
What is the InChIKey of N-(1-quinolin-2-ylcyclohexyl)propanamide?
The InChIKey is QIVKXZMSRMSTCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-2-17(21)20-18(12-6-3-7-13-18)16-11-10-14-8-4-5-9-15(14)19-16/h4-5,8-11H,2-3,6-7,12-13H2,1H3,(H,20,21).
What are the key properties of N-(1-quinolin-2-ylcyclohexyl)propanamide?
N-(1-quinolin-2-ylcyclohexyl)propanamide has a molecular weight of 282.39 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-quinolin-2-ylcyclohexyl)propanamide is sourced from PubChem (CID 137371294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).