N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide

C14H23NO2 — CID 2921260

IUPACN,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide
SMILESCCN(CC)C(=O)C1CC2CCCC(C1)C2=O
InChIInChI=1S/C14H23NO2/c1-3-15(4-2)14(17)12-8-10-6-5-7-11(9-12)13(10)16/h10-12H,3-9H2,1-2H3
InChIKeySJQNRBALVVJKLQ-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.25
Rot. Bonds3

About N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide

N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide (PubChem CID 2921260) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide
PubChem CID2921260
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide
SMILESCCN(CC)C(=O)C1CC2CCCC(C1)C2=O
InChIInChI=1S/C14H23NO2/c1-3-15(4-2)14(17)12-8-10-6-5-7-11(9-12)13(10)16/h10-12H,3-9H2,1-2H3
InChIKeySJQNRBALVVJKLQ-UHFFFAOYSA-N
XLogP2.25
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide?
The IUPAC name of N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide (CID 2921260) is N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide.
What is the SMILES notation for N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide?
The canonical SMILES for N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide is CCN(CC)C(=O)C1CC2CCCC(C1)C2=O.
What is the InChIKey of N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide?
The InChIKey is SJQNRBALVVJKLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-3-15(4-2)14(17)12-8-10-6-5-7-11(9-12)13(10)16/h10-12H,3-9H2,1-2H3.
What are the key properties of N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide?
N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide has a molecular weight of 237.34 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-9-oxobicyclo[3.3.1]nonane-3-carboxamide is sourced from PubChem (CID 2921260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).