3-(methoxymethylamino)propan-1-ol

C5H13NO2 — CID 144789078

IUPAC3-(methoxymethylamino)propan-1-ol
SMILESCOCNCCCO
InChIInChI=1S/C5H13NO2/c1-8-5-6-3-2-4-7/h6-7H,2-5H2,1H3
InChIKeyOIXCWDBSVJDOSA-UHFFFAOYSA-N
MW119.16 g/mol
LogP-0.44
Rot. Bonds5

About 3-(methoxymethylamino)propan-1-ol

3-(methoxymethylamino)propan-1-ol (PubChem CID 144789078) has the molecular formula C5H13NO2 and a molecular weight of 119.16 g/mol. Its IUPAC name is 3-(methoxymethylamino)propan-1-ol.

Molecular Properties

Compound Name3-(methoxymethylamino)propan-1-ol
PubChem CID144789078
Molecular FormulaC5H13NO2
Molecular Weight119.16 g/mol
Exact Mass119.09
IUPAC Name3-(methoxymethylamino)propan-1-ol
SMILESCOCNCCCO
InChIInChI=1S/C5H13NO2/c1-8-5-6-3-2-4-7/h6-7H,2-5H2,1H3
InChIKeyOIXCWDBSVJDOSA-UHFFFAOYSA-N
XLogP-0.44
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.16
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 3-(methoxymethylamino)propan-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-(Methylamino)-1-propanol
CID 10148986
3-(Ethylamino)propanol
CID 10176104
1-Propanol, 3-(propylamino)-
CID 186621
2-((3-Methoxypropyl)amino)ethanol
CID 3016059
(2R)-2-methyl-3-(methylamino)propan-1-ol
CID 58246775
Dipropanolamine
CID 106986
(2S)-2-methyl-3-(methylamino)propan-1-ol
CID 55288272
Ethylamino propanol
CID 17998706
Methylaminopropanol
CID 18461939
N-propylaminoethanol
CID 19885411
Hydroxypropyl methyl ammonium chloride
CID 20030459
Methyldihydroxypropylamine
CID 20257798

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethylamino)propan-1-ol?
The IUPAC name of 3-(methoxymethylamino)propan-1-ol (CID 144789078) is 3-(methoxymethylamino)propan-1-ol.
What is the SMILES notation for 3-(methoxymethylamino)propan-1-ol?
The canonical SMILES for 3-(methoxymethylamino)propan-1-ol is COCNCCCO.
What is the InChIKey of 3-(methoxymethylamino)propan-1-ol?
The InChIKey is OIXCWDBSVJDOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO2/c1-8-5-6-3-2-4-7/h6-7H,2-5H2,1H3.
What are the key properties of 3-(methoxymethylamino)propan-1-ol?
3-(methoxymethylamino)propan-1-ol has a molecular weight of 119.16 g/mol, XLogP of -0.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethylamino)propan-1-ol is sourced from PubChem (CID 144789078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).