3-(4-methoxyphenyl)propan-1-amine

C10H15NO — CID 3029815

IUPAC3-(4-methoxyphenyl)propan-1-amine
SMILESCOc1ccc(CCCN)cc1
InChIInChI=1S/C10H15NO/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7H,2-3,8,11H2,1H3
InChIKeyNUZDQSUVPDNSSJ-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.59
Rot. Bonds4

About 3-(4-methoxyphenyl)propan-1-amine

3-(4-methoxyphenyl)propan-1-amine (PubChem CID 3029815) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)propan-1-amine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)propan-1-amine
PubChem CID3029815
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name3-(4-methoxyphenyl)propan-1-amine
SMILESCOc1ccc(CCCN)cc1
InChIInChI=1S/C10H15NO/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7H,2-3,8,11H2,1H3
InChIKeyNUZDQSUVPDNSSJ-UHFFFAOYSA-N
XLogP1.59
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4-methoxyphenyl)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

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)propan-1-amine?
The IUPAC name of 3-(4-methoxyphenyl)propan-1-amine (CID 3029815) is 3-(4-methoxyphenyl)propan-1-amine.
What is the SMILES notation for 3-(4-methoxyphenyl)propan-1-amine?
The canonical SMILES for 3-(4-methoxyphenyl)propan-1-amine is COc1ccc(CCCN)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)propan-1-amine?
The InChIKey is NUZDQSUVPDNSSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7H,2-3,8,11H2,1H3.
What are the key properties of 3-(4-methoxyphenyl)propan-1-amine?
3-(4-methoxyphenyl)propan-1-amine has a molecular weight of 165.24 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)propan-1-amine is sourced from PubChem (CID 3029815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).