2-(methoxymethyl)-N,2-dimethyldecan-1-amine

C14H31NO — CID 139968840

IUPAC2-(methoxymethyl)-N,2-dimethyldecan-1-amine
SMILESCCCCCCCCC(C)(CNC)COC
InChIInChI=1S/C14H31NO/c1-5-6-7-8-9-10-11-14(2,12-15-3)13-16-4/h15H,5-13H2,1-4H3
InChIKeyHCZVQSNVXFMTBT-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.61
Rot. Bonds11

About 2-(methoxymethyl)-N,2-dimethyldecan-1-amine

2-(methoxymethyl)-N,2-dimethyldecan-1-amine (PubChem CID 139968840) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is 2-(methoxymethyl)-N,2-dimethyldecan-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-N,2-dimethyldecan-1-amine
PubChem CID139968840
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC Name2-(methoxymethyl)-N,2-dimethyldecan-1-amine
SMILESCCCCCCCCC(C)(CNC)COC
InChIInChI=1S/C14H31NO/c1-5-6-7-8-9-10-11-14(2,12-15-3)13-16-4/h15H,5-13H2,1-4H3
InChIKeyHCZVQSNVXFMTBT-UHFFFAOYSA-N
XLogP3.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(methoxymethyl)-N,2-dimethyldecan-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 2-(methoxymethyl)-N,2-dimethyldecan-1-amine?
The IUPAC name of 2-(methoxymethyl)-N,2-dimethyldecan-1-amine (CID 139968840) is 2-(methoxymethyl)-N,2-dimethyldecan-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-N,2-dimethyldecan-1-amine?
The canonical SMILES for 2-(methoxymethyl)-N,2-dimethyldecan-1-amine is CCCCCCCCC(C)(CNC)COC.
What is the InChIKey of 2-(methoxymethyl)-N,2-dimethyldecan-1-amine?
The InChIKey is HCZVQSNVXFMTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-5-6-7-8-9-10-11-14(2,12-15-3)13-16-4/h15H,5-13H2,1-4H3.
What are the key properties of 2-(methoxymethyl)-N,2-dimethyldecan-1-amine?
2-(methoxymethyl)-N,2-dimethyldecan-1-amine has a molecular weight of 229.41 g/mol, XLogP of 3.61, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N,2-dimethyldecan-1-amine is sourced from PubChem (CID 139968840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).