1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol

C13H25NO2 — CID 65208804

IUPAC1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
SMILESCN(CC1CCCO1)CC1(O)CCCCC1
InChIInChI=1S/C13H25NO2/c1-14(10-12-6-5-9-16-12)11-13(15)7-3-2-4-8-13/h12,15H,2-11H2,1H3
InChIKeyDXRPOUPFESRROQ-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.79
Rot. Bonds4

About 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol

1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol (PubChem CID 65208804) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
PubChem CID65208804
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
SMILESCN(CC1CCCO1)CC1(O)CCCCC1
InChIInChI=1S/C13H25NO2/c1-14(10-12-6-5-9-16-12)11-13(15)7-3-2-4-8-13/h12,15H,2-11H2,1H3
InChIKeyDXRPOUPFESRROQ-UHFFFAOYSA-N
XLogP1.79
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol 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-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol (CID 65208804) is 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol is CN(CC1CCCO1)CC1(O)CCCCC1.
What is the InChIKey of 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
The InChIKey is DXRPOUPFESRROQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-14(10-12-6-5-9-16-12)11-13(15)7-3-2-4-8-13/h12,15H,2-11H2,1H3.
What are the key properties of 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol has a molecular weight of 227.35 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 65208804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).