N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide

C20H28N2O — CID 142912156

IUPACN-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide
SMILESCCC1CC2CCC(C2)C1NC(=O)N1CCCc2ccccc21
InChIInChI=1S/C20H28N2O/c1-2-15-12-14-9-10-17(13-14)19(15)21-20(23)22-11-5-7-16-6-3-4-8-18(16)22/h3-4,6,8,14-15,17,19H,2,5,7,9-13H2,1H3,(H,21,23)
InChIKeyLXOMJXXILZODOG-UHFFFAOYSA-N
MW312.46 g/mol
LogP4.36
Rot. Bonds2

About N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide

N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide (PubChem CID 142912156) has the molecular formula C20H28N2O and a molecular weight of 312.46 g/mol. Its IUPAC name is N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide.

Molecular Properties

Compound NameN-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide
PubChem CID142912156
Molecular FormulaC20H28N2O
Molecular Weight312.46 g/mol
Exact Mass312.22
IUPAC NameN-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide
SMILESCCC1CC2CCC(C2)C1NC(=O)N1CCCc2ccccc21
InChIInChI=1S/C20H28N2O/c1-2-15-12-14-9-10-17(13-14)19(15)21-20(23)22-11-5-7-16-6-3-4-8-18(16)22/h3-4,6,8,14-15,17,19H,2,5,7,9-13H2,1H3,(H,21,23)
InChIKeyLXOMJXXILZODOG-UHFFFAOYSA-N
XLogP4.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.46
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1R,3S)-5-hydroxy-2-adamantyl]-3,4-dihydro-2H-quinoline-1-carboxamide
CID 59658107
N-cyclopropyl-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 113225655
N-cycloheptyl-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 69221349
2-(3,4-dihydro-2H-quinoline-1-carbonylamino)butanoic acid
CID 61185072
3-(3,4-dihydro-2H-quinoline-1-carbonylamino)-3-methylbutanoic acid
CID 64702390
3-(3,4-dihydro-2H-quinoline-1-carbonylamino)-2-methylpropanoic acid
CID 62669562
N-(3,4-dihydro-2H-chromen-4-yl)-3,4-dihydro-2H-quinoline-1-carboxamide
CID 110866329
N-(oxiran-2-ylmethyl)-3,4-dihydro-2H-quinoline-1-carboxamide
CID 150484451
(2S)-2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-3,3-dimethylbutanoic acid
CID 61184377
N-(2-cyclopentylethyl)-2,3-dihydroindole-1-carboxamide
CID 126767555
2-(3,4-dihydro-2H-quinoline-1-carbonylamino)-3,3-dimethylbutanoic acid
CID 61184900
N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-2,3-dihydroindole-1-carboxamide
CID 14809231

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide?
The IUPAC name of N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide (CID 142912156) is N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide.
What is the SMILES notation for N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide?
The canonical SMILES for N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide is CCC1CC2CCC(C2)C1NC(=O)N1CCCc2ccccc21.
What is the InChIKey of N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide?
The InChIKey is LXOMJXXILZODOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O/c1-2-15-12-14-9-10-17(13-14)19(15)21-20(23)22-11-5-7-16-6-3-4-8-18(16)22/h3-4,6,8,14-15,17,19H,2,5,7,9-13H2,1H3,(H,21,23).
What are the key properties of N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide?
N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide has a molecular weight of 312.46 g/mol, XLogP of 4.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-bicyclo[3.2.1]octanyl)-3,4-dihydro-2H-quinoline-1-carboxamide is sourced from PubChem (CID 142912156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).