N,N-diethylcyclohex-3-en-1-amine

C10H19N — CID 10953728

IUPACN,N-diethylcyclohex-3-en-1-amine
SMILESCCN(CC)C1CC=CCC1
InChIInChI=1S/C10H19N/c1-3-11(4-2)10-8-6-5-7-9-10/h5-6,10H,3-4,7-9H2,1-2H3
InChIKeyJOPQEOQCDRCMGK-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.44
Rot. Bonds3

About N,N-diethylcyclohex-3-en-1-amine

N,N-diethylcyclohex-3-en-1-amine (PubChem CID 10953728) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is N,N-diethylcyclohex-3-en-1-amine.

Molecular Properties

Compound NameN,N-diethylcyclohex-3-en-1-amine
PubChem CID10953728
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC NameN,N-diethylcyclohex-3-en-1-amine
SMILESCCN(CC)C1CC=CCC1
InChIInChI=1S/C10H19N/c1-3-11(4-2)10-8-6-5-7-9-10/h5-6,10H,3-4,7-9H2,1-2H3
InChIKeyJOPQEOQCDRCMGK-UHFFFAOYSA-N
XLogP2.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N,N-diethylcyclohex-3-en-1-amine 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-cyclobutyl-N-methylcyclohex-3-en-1-amine
CID 145406243
cyclohex-3-en-1-yl(methyl)carbamic acid
CID 141218160
N,N-diethylcyclobutanamine;ethane
CID 170746144
N-(1,3-benzodioxol-5-ylmethyl)-N-methylcyclohex-3-en-1-amine
CID 53412236
N,N-diethylcycloundecanamine
CID 163828609
4-propylcyclohexene
CID 518777
N,N-diethylpyrrolidin-1-ium-3-amine
CID 142960286
N,N-diethyl-4-methylcyclohexan-1-amine;ethane
CID 145372894
N'-(cyclohex-3-en-1-ylmethyl)-N'-ethyl-N,N-dimethylethane-1,2-diamine
CID 2845835
ethane;(4S,5S)-4-ethyl-5-methylcycloheptene
CID 169190782
1-cyclohex-3-en-1-yl-N,N-dimethylmethanamine;ethane
CID 177009709
(4S)-4-[(2S)-butan-2-yl]cyclohexene
CID 175915978

Frequently Asked Questions

What is the IUPAC name of N,N-diethylcyclohex-3-en-1-amine?
The IUPAC name of N,N-diethylcyclohex-3-en-1-amine (CID 10953728) is N,N-diethylcyclohex-3-en-1-amine.
What is the SMILES notation for N,N-diethylcyclohex-3-en-1-amine?
The canonical SMILES for N,N-diethylcyclohex-3-en-1-amine is CCN(CC)C1CC=CCC1.
What is the InChIKey of N,N-diethylcyclohex-3-en-1-amine?
The InChIKey is JOPQEOQCDRCMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-3-11(4-2)10-8-6-5-7-9-10/h5-6,10H,3-4,7-9H2,1-2H3.
What are the key properties of N,N-diethylcyclohex-3-en-1-amine?
N,N-diethylcyclohex-3-en-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylcyclohex-3-en-1-amine is sourced from PubChem (CID 10953728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).