2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol

C13H25NO — CID 102870175

IUPAC2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol
SMILESCC1CCCC(N(CCO)C2CCC2)C1
InChIInChI=1S/C13H25NO/c1-11-4-2-7-13(10-11)14(8-9-15)12-5-3-6-12/h11-13,15H,2-10H2,1H3
InChIKeyOOFIXWYHGGRZLP-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.41
Rot. Bonds4

About 2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol

2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol (PubChem CID 102870175) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol
PubChem CID102870175
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol
SMILESCC1CCCC(N(CCO)C2CCC2)C1
InChIInChI=1S/C13H25NO/c1-11-4-2-7-13(10-11)14(8-9-15)12-5-3-6-12/h11-13,15H,2-10H2,1H3
InChIKeyOOFIXWYHGGRZLP-UHFFFAOYSA-N
XLogP2.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[cyclobutyl-(3-methylcyclohexyl)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-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol?
The IUPAC name of 2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol (CID 102870175) is 2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol.
What is the SMILES notation for 2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol?
The canonical SMILES for 2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol is CC1CCCC(N(CCO)C2CCC2)C1.
What is the InChIKey of 2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol?
The InChIKey is OOFIXWYHGGRZLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11-4-2-7-13(10-11)14(8-9-15)12-5-3-6-12/h11-13,15H,2-10H2,1H3.
What are the key properties of 2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol?
2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol has a molecular weight of 211.35 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl-(3-methylcyclohexyl)amino]ethanol is sourced from PubChem (CID 102870175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).