6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol

C13H27NO2 — CID 103737833

IUPAC6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol
SMILESCN(CCCCCCO)CC1CCCCO1
InChIInChI=1S/C13H27NO2/c1-14(9-5-2-3-6-10-15)12-13-8-4-7-11-16-13/h13,15H,2-12H2,1H3
InChIKeySYQXVVMDTDVEJZ-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.04
Rot. Bonds8

About 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol

6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol (PubChem CID 103737833) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol.

Molecular Properties

Compound Name6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol
PubChem CID103737833
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol
SMILESCN(CCCCCCO)CC1CCCCO1
InChIInChI=1S/C13H27NO2/c1-14(9-5-2-3-6-10-15)12-13-8-4-7-11-16-13/h13,15H,2-12H2,1H3
InChIKeySYQXVVMDTDVEJZ-UHFFFAOYSA-N
XLogP2.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-[methyl(oxan-2-ylmethyl)amino]hexan-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

Related Compounds

3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol
CID 60965354
N,N'-dimethyl-N'-(oxan-2-ylmethyl)butane-1,4-diamine
CID 61436273
5-[methyl(oxiran-2-ylmethyl)amino]pentan-1-ol
CID 107198922
N-methyl-N-(oxan-2-ylmethyl)propan-1-amine
CID 169307436
N-methyl-N-(oxepan-2-ylmethyl)propan-1-amine
CID 169307437
2-chloro-N-methyl-N-(oxolan-2-ylmethyl)ethanamine
CID 61436036
N,N'-dimethyl-N'-(oxolan-2-ylmethyl)propane-1,3-diamine
CID 61436191
N-[3-[methyl-[[(2R)-oxan-2-yl]methyl]amino]propyl]methanesulfonamide
CID 97061252
N'-methyl-N-(2-methylpropyl)-N'-(oxan-2-ylmethyl)butane-1,4-diamine
CID 62429589
3-[methyl(oxan-2-ylmethyl)amino]propanenitrile
CID 43403608
2,2-dimethyl-6-[methyl(oxan-2-ylmethyl)amino]hexanimidamide
CID 106712008
methyl 3-[methyl(oxan-2-ylmethyl)amino]propanoate
CID 61233938

Frequently Asked Questions

What is the IUPAC name of 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol?
The IUPAC name of 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol (CID 103737833) is 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol.
What is the SMILES notation for 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol?
The canonical SMILES for 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol is CN(CCCCCCO)CC1CCCCO1.
What is the InChIKey of 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol?
The InChIKey is SYQXVVMDTDVEJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-14(9-5-2-3-6-10-15)12-13-8-4-7-11-16-13/h13,15H,2-12H2,1H3.
What are the key properties of 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol?
6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol has a molecular weight of 229.36 g/mol, XLogP of 2.04, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[methyl(oxan-2-ylmethyl)amino]hexan-1-ol is sourced from PubChem (CID 103737833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).