[3-(2-benzofuran-4-yl)phenyl]methanamine

C15H13NO — CID 175083312

IUPAC[3-(2-benzofuran-4-yl)phenyl]methanamine
SMILESNCc1cccc(-c2cccc3cocc23)c1
InChIInChI=1S/C15H13NO/c16-8-11-3-1-4-12(7-11)14-6-2-5-13-9-17-10-15(13)14/h1-7,9-10H,8,16H2
InChIKeyHKQVWPSVHGHZSL-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.56
Rot. Bonds2

About [3-(2-benzofuran-4-yl)phenyl]methanamine

[3-(2-benzofuran-4-yl)phenyl]methanamine (PubChem CID 175083312) has the molecular formula C15H13NO and a molecular weight of 223.28 g/mol. Its IUPAC name is [3-(2-benzofuran-4-yl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(2-benzofuran-4-yl)phenyl]methanamine
PubChem CID175083312
Molecular FormulaC15H13NO
Molecular Weight223.28 g/mol
Exact Mass223.10
IUPAC Name[3-(2-benzofuran-4-yl)phenyl]methanamine
SMILESNCc1cccc(-c2cccc3cocc23)c1
InChIInChI=1S/C15H13NO/c16-8-11-3-1-4-12(7-11)14-6-2-5-13-9-17-10-15(13)14/h1-7,9-10H,8,16H2
InChIKeyHKQVWPSVHGHZSL-UHFFFAOYSA-N
XLogP3.56
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-(1-benzothiophen-7-yl)phenyl]methanamine
CID 81154276
[3-(2-chlorophenyl)phenyl]methanamine
CID 1392189
1-[7-[3-(aminomethyl)phenyl]-1-benzofuran-2-yl]ethanol
CID 160723042
2-[2-[3-(aminomethyl)phenyl]phenyl]aniline
CID 174455966
5-[3-(aminomethyl)phenyl]-3-ethylquinolin-2-amine
CID 126656197
[3-(2,4,5-trimethylphenyl)phenyl]methanamine
CID 64985236
8-[3-(aminomethyl)phenyl]-3-ethyl-2-phenylisoquinolin-1-one
CID 144514912
[3-(aminomethyl)phenyl]methanamine;azane
CID 175725248
[3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine
CID 115046706
[3-(4-methylphenyl)phenyl]methanamine
CID 1392243
[3-(5-fluoro-1-propan-2-ylpyrazol-4-yl)phenyl]methanamine
CID 114244098
2-[2-[[7-[3-(aminomethyl)phenyl]-1-benzofuran-5-yl]methoxy]-3-(furan-3-yl)phenyl]acetic acid
CID 139560835

Frequently Asked Questions

What is the IUPAC name of [3-(2-benzofuran-4-yl)phenyl]methanamine?
The IUPAC name of [3-(2-benzofuran-4-yl)phenyl]methanamine (CID 175083312) is [3-(2-benzofuran-4-yl)phenyl]methanamine.
What is the SMILES notation for [3-(2-benzofuran-4-yl)phenyl]methanamine?
The canonical SMILES for [3-(2-benzofuran-4-yl)phenyl]methanamine is NCc1cccc(-c2cccc3cocc23)c1.
What is the InChIKey of [3-(2-benzofuran-4-yl)phenyl]methanamine?
The InChIKey is HKQVWPSVHGHZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c16-8-11-3-1-4-12(7-11)14-6-2-5-13-9-17-10-15(13)14/h1-7,9-10H,8,16H2.
What are the key properties of [3-(2-benzofuran-4-yl)phenyl]methanamine?
[3-(2-benzofuran-4-yl)phenyl]methanamine has a molecular weight of 223.28 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-benzofuran-4-yl)phenyl]methanamine is sourced from PubChem (CID 175083312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).