1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine

C14H17NO — CID 106887032

IUPAC1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine
SMILESCNCc1occc1-c1cccc(C)c1C
InChIInChI=1S/C14H17NO/c1-10-5-4-6-12(11(10)2)13-7-8-16-14(13)9-15-3/h4-8,15H,9H2,1-3H3
InChIKeyNFNLRHRWWBWVNE-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.28
Rot. Bonds3

About 1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine

1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine (PubChem CID 106887032) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine
PubChem CID106887032
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine
SMILESCNCc1occc1-c1cccc(C)c1C
InChIInChI=1S/C14H17NO/c1-10-5-4-6-12(11(10)2)13-7-8-16-14(13)9-15-3/h4-8,15H,9H2,1-3H3
InChIKeyNFNLRHRWWBWVNE-UHFFFAOYSA-N
XLogP3.28
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[3-(2,3-dimethylphenyl)furan-2-yl]-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-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine (CID 106887032) is 1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine is CNCc1occc1-c1cccc(C)c1C.
What is the InChIKey of 1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine?
The InChIKey is NFNLRHRWWBWVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-10-5-4-6-12(11(10)2)13-7-8-16-14(13)9-15-3/h4-8,15H,9H2,1-3H3.
What are the key properties of 1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine?
1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine has a molecular weight of 215.30 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2,3-dimethylphenyl)furan-2-yl]-N-methylmethanamine is sourced from PubChem (CID 106887032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).