1-(3-methoxyphenyl)-N-methylmethanamine

C9H13NO — CID 5152225

IUPAC1-(3-methoxyphenyl)-N-methylmethanamine
SMILESCNCc1cccc(OC)c1
InChIInChI=1S/C9H13NO/c1-10-7-8-4-3-5-9(6-8)11-2/h3-6,10H,7H2,1-2H3
InChIKeyFIFKRPFWLHBMHL-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.41
Rot. Bonds3

About 1-(3-methoxyphenyl)-N-methylmethanamine

1-(3-methoxyphenyl)-N-methylmethanamine (PubChem CID 5152225) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-N-methylmethanamine
PubChem CID5152225
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name1-(3-methoxyphenyl)-N-methylmethanamine
SMILESCNCc1cccc(OC)c1
InChIInChI=1S/C9H13NO/c1-10-7-8-4-3-5-9(6-8)11-2/h3-6,10H,7H2,1-2H3
InChIKeyFIFKRPFWLHBMHL-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-methoxyphenyl)-N-methylmethanamine 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 1-(3-methoxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(3-methoxyphenyl)-N-methylmethanamine (CID 5152225) is 1-(3-methoxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-methoxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(3-methoxyphenyl)-N-methylmethanamine is CNCc1cccc(OC)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-N-methylmethanamine?
The InChIKey is FIFKRPFWLHBMHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-10-7-8-4-3-5-9(6-8)11-2/h3-6,10H,7H2,1-2H3.
What are the key properties of 1-(3-methoxyphenyl)-N-methylmethanamine?
1-(3-methoxyphenyl)-N-methylmethanamine has a molecular weight of 151.21 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 5152225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).