3-methoxy-1-(oxolan-3-yl)propan-1-amine

C8H17NO2 — CID 63563045

IUPAC3-methoxy-1-(oxolan-3-yl)propan-1-amine
SMILESCOCCC(N)C1CCOC1
InChIInChI=1S/C8H17NO2/c1-10-4-3-8(9)7-2-5-11-6-7/h7-8H,2-6,9H2,1H3
InChIKeyVGXHXQBUBCLRDO-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.39
Rot. Bonds4

About 3-methoxy-1-(oxolan-3-yl)propan-1-amine

3-methoxy-1-(oxolan-3-yl)propan-1-amine (PubChem CID 63563045) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 3-methoxy-1-(oxolan-3-yl)propan-1-amine.

Molecular Properties

Compound Name3-methoxy-1-(oxolan-3-yl)propan-1-amine
PubChem CID63563045
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name3-methoxy-1-(oxolan-3-yl)propan-1-amine
SMILESCOCCC(N)C1CCOC1
InChIInChI=1S/C8H17NO2/c1-10-4-3-8(9)7-2-5-11-6-7/h7-8H,2-6,9H2,1H3
InChIKeyVGXHXQBUBCLRDO-UHFFFAOYSA-N
XLogP0.39
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-1-(oxolan-3-yl)propan-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

Related Compounds

1-(Oxolan-3-yl)propan-1-amine
CID 54595718
1-(Oxolan-3-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103148093
1-(Oxolan-3-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103148093
N-methyl-1-(oxolan-3-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103148361
3-(2,2-Difluoroethoxy)-1-(oxolan-3-yl)propan-1-amine
CID 103148986
3-(2,2-difluoroethoxy)-N-methyl-1-(oxolan-3-yl)propan-1-amine
CID 103149317
N-methyl-1-(oxolan-3-yl)propan-1-amine
CID 63563986
N-methyl-1-(oxolan-3-yl)propan-1-amine
CID 63563986
1,6-Diethoxy-3-(2-ethoxyethyl)hexane-3,4-diamine
CID 90412101
(1S)-1-[(3R)-oxolan-3-yl]propan-1-amine
CID 95566526
(1R)-1-[(3R)-oxolan-3-yl]propan-1-amine
CID 95566527
(1R)-1-[(3S)-oxolan-3-yl]propan-1-amine
CID 95566525

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-(oxolan-3-yl)propan-1-amine?
The IUPAC name of 3-methoxy-1-(oxolan-3-yl)propan-1-amine (CID 63563045) is 3-methoxy-1-(oxolan-3-yl)propan-1-amine.
What is the SMILES notation for 3-methoxy-1-(oxolan-3-yl)propan-1-amine?
The canonical SMILES for 3-methoxy-1-(oxolan-3-yl)propan-1-amine is COCCC(N)C1CCOC1.
What is the InChIKey of 3-methoxy-1-(oxolan-3-yl)propan-1-amine?
The InChIKey is VGXHXQBUBCLRDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-10-4-3-8(9)7-2-5-11-6-7/h7-8H,2-6,9H2,1H3.
What are the key properties of 3-methoxy-1-(oxolan-3-yl)propan-1-amine?
3-methoxy-1-(oxolan-3-yl)propan-1-amine has a molecular weight of 159.23 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-(oxolan-3-yl)propan-1-amine is sourced from PubChem (CID 63563045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).