N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide

C15H23NO2 — CID 42947674

IUPACN-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide
SMILESCCN(C(=O)C1CC2CCCC(C1)C2=O)C1CC1
InChIInChI=1S/C15H23NO2/c1-2-16(13-6-7-13)15(18)12-8-10-4-3-5-11(9-12)14(10)17/h10-13H,2-9H2,1H3
InChIKeyVMBNLEMVPLUQRC-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.39
Rot. Bonds3

About N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide

N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide (PubChem CID 42947674) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide
PubChem CID42947674
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide
SMILESCCN(C(=O)C1CC2CCCC(C1)C2=O)C1CC1
InChIInChI=1S/C15H23NO2/c1-2-16(13-6-7-13)15(18)12-8-10-4-3-5-11(9-12)14(10)17/h10-13H,2-9H2,1H3
InChIKeyVMBNLEMVPLUQRC-UHFFFAOYSA-N
XLogP2.39
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide
CID 42940625
1-N,4-N-dicyclopentyl-1-N,4-N-diethylcyclohexane-1,4-dicarboxamide
CID 55587581
N-cyclohexyl-N-ethylcyclobutanecarboxamide
CID 78833458
N-(4-aminocyclohexyl)-N-ethylcyclobutanecarboxamide
CID 79116436
N-cyclohexyl-N-ethyl-2-methylpiperidine-4-carboxamide
CID 106738612
N-cyclopropyl-N-ethylpiperidine-4-carboxamide
CID 43264267
N-cyclopentyl-N-ethylpiperidine-4-carboxamide;hydrochloride
CID 119288620
9-oxo-N-[4-[(9-oxobicyclo[3.3.1]nonane-3-carbonyl)amino]but-2-ynyl]bicyclo[3.3.1]nonane-3-carboxamide
CID 167908810
3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride
CID 119674160
N-cyclohexyl-N-ethyl-2-methylcyclopropane-1-carboxamide
CID 78833407
N-cyclopentyl-N-ethylcyclohex-3-ene-1-carboxamide
CID 86926977
N-cyclopentyl-N-ethylcarbamoyl chloride
CID 15335411

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide?
The IUPAC name of N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide (CID 42947674) is N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide?
The canonical SMILES for N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide is CCN(C(=O)C1CC2CCCC(C1)C2=O)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide?
The InChIKey is VMBNLEMVPLUQRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-2-16(13-6-7-13)15(18)12-8-10-4-3-5-11(9-12)14(10)17/h10-13H,2-9H2,1H3.
What are the key properties of N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide?
N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide has a molecular weight of 249.35 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide is sourced from PubChem (CID 42947674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).