2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine

C18H19NO — CID 65440953

IUPAC2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine
SMILESCC(C)C(N)c1cc2cccc(-c3ccccc3)c2o1
InChIInChI=1S/C18H19NO/c1-12(2)17(19)16-11-14-9-6-10-15(18(14)20-16)13-7-4-3-5-8-13/h3-12,17H,19H2,1-2H3
InChIKeySHZJMRZVWUCKTB-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.76
Rot. Bonds3

About 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine

2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine (PubChem CID 65440953) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine
PubChem CID65440953
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine
SMILESCC(C)C(N)c1cc2cccc(-c3ccccc3)c2o1
InChIInChI=1S/C18H19NO/c1-12(2)17(19)16-11-14-9-6-10-15(18(14)20-16)13-7-4-3-5-8-13/h3-12,17H,19H2,1-2H3
InChIKeySHZJMRZVWUCKTB-UHFFFAOYSA-N
XLogP4.76
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-1-(7-phenyl-1-benzofuran-2-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

ethyl 2-(7-phenyl-1-benzofuran-2-yl)propanoate
CID 21447351
2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-one
CID 65426129
1-[7-[3-(aminomethyl)phenyl]-1-benzofuran-2-yl]ethanol
CID 160723042
1-(6,7-difluoro-1-benzofuran-2-yl)-2-methylpropan-1-amine
CID 65440612
2-(1-aminoethyl)-1-benzofuran-7-ol
CID 82599376
4,4,5,5-tetramethyl-2-(7-phenyl-1-benzofuran-2-yl)-1,3,2-dioxaborolane
CID 140898384
2-ethoxy-1-(7-fluoro-1-benzofuran-2-yl)propan-1-amine
CID 114728785
(1S)-2-methyl-1-(5-phenylquinazolin-2-yl)propan-1-amine
CID 132917665
2-ethoxy-1-(7-fluoro-1-benzofuran-2-yl)-3-methylbutan-1-amine
CID 114731187
1-(7-chloro-1-benzofuran-2-yl)-2-methylpropan-1-ol
CID 65426322
1-(7-bromo-5-methyl-1-benzofuran-2-yl)-2-methylpropan-1-amine
CID 65438472
2-methyl-1-(2-methyl-5-phenyl-1,2,4-triazol-3-yl)propan-1-amine
CID 62721278

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine?
The IUPAC name of 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine (CID 65440953) is 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine.
What is the SMILES notation for 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine?
The canonical SMILES for 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine is CC(C)C(N)c1cc2cccc(-c3ccccc3)c2o1.
What is the InChIKey of 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine?
The InChIKey is SHZJMRZVWUCKTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c1-12(2)17(19)16-11-14-9-6-10-15(18(14)20-16)13-7-4-3-5-8-13/h3-12,17H,19H2,1-2H3.
What are the key properties of 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine?
2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine has a molecular weight of 265.36 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-amine is sourced from PubChem (CID 65440953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).