1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine

C14H25NO — CID 65156043

IUPAC1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine
SMILESCNC(CCC1CCCO1)C1=CCCCC1
InChIInChI=1S/C14H25NO/c1-15-14(12-6-3-2-4-7-12)10-9-13-8-5-11-16-13/h6,13-15H,2-5,7-11H2,1H3
InChIKeyHFCZDYFBMIXRIB-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.03
Rot. Bonds5

About 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine

1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine (PubChem CID 65156043) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine
PubChem CID65156043
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine
SMILESCNC(CCC1CCCO1)C1=CCCCC1
InChIInChI=1S/C14H25NO/c1-15-14(12-6-3-2-4-7-12)10-9-13-8-5-11-16-13/h6,13-15H,2-5,7-11H2,1H3
InChIKeyHFCZDYFBMIXRIB-UHFFFAOYSA-N
XLogP3.03
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-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

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine?
The IUPAC name of 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine (CID 65156043) is 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine.
What is the SMILES notation for 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine?
The canonical SMILES for 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine is CNC(CCC1CCCO1)C1=CCCCC1.
What is the InChIKey of 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine?
The InChIKey is HFCZDYFBMIXRIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-15-14(12-6-3-2-4-7-12)10-9-13-8-5-11-16-13/h6,13-15H,2-5,7-11H2,1H3.
What are the key properties of 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine?
1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine has a molecular weight of 223.36 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)-N-methyl-3-(oxolan-2-yl)propan-1-amine is sourced from PubChem (CID 65156043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).