3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine

C11H26N2O — CID 107505411

IUPAC3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine
SMILESCCC(CC)N(C)CC(COC)NC
InChIInChI=1S/C11H26N2O/c1-6-11(7-2)13(4)8-10(12-3)9-14-5/h10-12H,6-9H2,1-5H3
InChIKeyVSDGDJBYPBQGRF-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.34
Rot. Bonds8

About 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine

3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine (PubChem CID 107505411) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine.

Molecular Properties

Compound Name3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine
PubChem CID107505411
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine
SMILESCCC(CC)N(C)CC(COC)NC
InChIInChI=1S/C11H26N2O/c1-6-11(7-2)13(4)8-10(12-3)9-14-5/h10-12H,6-9H2,1-5H3
InChIKeyVSDGDJBYPBQGRF-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine 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-methoxy-1-N,2-N-dimethyl-1-N-(4-methylpentan-2-yl)propane-1,2-diamine
CID 107505560
3-methoxy-1-N,2-N-dimethyl-1-N-(3-methylbutan-2-yl)propane-1,2-diamine
CID 107505408
3-(methylamino)-4-[methyl(pentan-3-yl)amino]butan-1-ol
CID 64899677
1-N-[1-(dimethylamino)propan-2-yl]-1-N-ethyl-3-methoxy-2-N-methylpropane-1,2-diamine
CID 107505986
1,3-dimethoxy-N-methylpropan-2-amine;ethane
CID 171819113
N-(2,2-dimethoxyethyl)-N-methylpentan-3-amine
CID 66221244
1-methoxy-N,2,6-trimethyloctan-4-amine
CID 105138500
(2S)-1-N-(2-methoxyethyl)-1-N,2-N-dimethylbutane-1,2-diamine
CID 167207521
2-(1-methoxybutan-2-yl)-1,1-dimethylhydrazine
CID 83007335
1-N-(cyclobutylmethyl)-3-methoxy-1-N,2-N-dimethylpropane-1,2-diamine
CID 107505670
3-methoxy-2-N-methyl-1-N-pentyl-1-N-propan-2-ylpropane-1,2-diamine
CID 107505554
1-methoxy-N-methyl-N-(phosphanylmethyl)butan-2-amine
CID 177367561

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine?
The IUPAC name of 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine (CID 107505411) is 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine.
What is the SMILES notation for 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine?
The canonical SMILES for 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine is CCC(CC)N(C)CC(COC)NC.
What is the InChIKey of 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine?
The InChIKey is VSDGDJBYPBQGRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-6-11(7-2)13(4)8-10(12-3)9-14-5/h10-12H,6-9H2,1-5H3.
What are the key properties of 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine?
3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine has a molecular weight of 202.34 g/mol, XLogP of 1.34, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-N,2-N-dimethyl-1-N-pentan-3-ylpropane-1,2-diamine is sourced from PubChem (CID 107505411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).