2-[cyclohexen-1-yl(methyl)amino]ethanol

C9H17NO — CID 54089646

IUPAC2-[cyclohexen-1-yl(methyl)amino]ethanol
SMILESCN(CCO)C1=CCCCC1
InChIInChI=1S/C9H17NO/c1-10(7-8-11)9-5-3-2-4-6-9/h5,11H,2-4,6-8H2,1H3
InChIKeyMSYHQJQYYOPMOL-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.37
Rot. Bonds3

About 2-[cyclohexen-1-yl(methyl)amino]ethanol

2-[cyclohexen-1-yl(methyl)amino]ethanol (PubChem CID 54089646) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-[cyclohexen-1-yl(methyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclohexen-1-yl(methyl)amino]ethanol
PubChem CID54089646
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-[cyclohexen-1-yl(methyl)amino]ethanol
SMILESCN(CCO)C1=CCCCC1
InChIInChI=1S/C9H17NO/c1-10(7-8-11)9-5-3-2-4-6-9/h5,11H,2-4,6-8H2,1H3
InChIKeyMSYHQJQYYOPMOL-UHFFFAOYSA-N
XLogP1.37
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[cyclohexen-1-yl(methyl)amino]ethanol 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 2-[cyclohexen-1-yl(methyl)amino]ethanol?
The IUPAC name of 2-[cyclohexen-1-yl(methyl)amino]ethanol (CID 54089646) is 2-[cyclohexen-1-yl(methyl)amino]ethanol.
What is the SMILES notation for 2-[cyclohexen-1-yl(methyl)amino]ethanol?
The canonical SMILES for 2-[cyclohexen-1-yl(methyl)amino]ethanol is CN(CCO)C1=CCCCC1.
What is the InChIKey of 2-[cyclohexen-1-yl(methyl)amino]ethanol?
The InChIKey is MSYHQJQYYOPMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-10(7-8-11)9-5-3-2-4-6-9/h5,11H,2-4,6-8H2,1H3.
What are the key properties of 2-[cyclohexen-1-yl(methyl)amino]ethanol?
2-[cyclohexen-1-yl(methyl)amino]ethanol has a molecular weight of 155.24 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexen-1-yl(methyl)amino]ethanol is sourced from PubChem (CID 54089646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).