[(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine

C17H16N2O — CID 95220358

IUPAC[(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
SMILESNC[C@H]1Cc2cccc(-c3ccc4[nH]ccc4c3)c2O1
InChIInChI=1S/C17H16N2O/c18-10-14-9-13-2-1-3-15(17(13)20-14)11-4-5-16-12(8-11)6-7-19-16/h1-8,14,19H,9-10,18H2/t14-/m1/s1
InChIKeyFJJVPHHQYJTRAZ-CQSZACIVSA-N
MW264.33 g/mol
LogP3.10
Rot. Bonds2

About [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine

[(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine (PubChem CID 95220358) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine.

Molecular Properties

Compound Name[(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
PubChem CID95220358
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name[(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
SMILESNC[C@H]1Cc2cccc(-c3ccc4[nH]ccc4c3)c2O1
InChIInChI=1S/C17H16N2O/c18-10-14-9-13-2-1-3-15(17(13)20-14)11-4-5-16-12(8-11)6-7-19-16/h1-8,14,19H,9-10,18H2/t14-/m1/s1
InChIKeyFJJVPHHQYJTRAZ-CQSZACIVSA-N
XLogP3.10
TPSA51.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine 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

[7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 56711734
[7-(2,6-dimethyl-4-pyridinyl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 56701421
[7-(1H-pyrazol-4-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 56716314
3-[(2S)-2-(aminomethyl)-2,3-dihydro-1-benzofuran-7-yl]-1H-quinolin-2-one
CID 95204666
[(2R)-7-[3-(2-methoxyphenyl)phenyl]-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 95217944
[7-[3-(2,2,2-trifluoroethyl)phenyl]-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 69206408
[(2R)-7-(2,6-dimethylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 129383306
[7-(2,6-dimethylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 11960767
[(2S)-7-(3-fluoro-4-methoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 95229130
5-[2-(1H-indol-5-yl)phenyl]-1H-indole
CID 102414263
[(2R)-7-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 11964054
[7-(2,3-dichlorophenyl)-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 69112690

Frequently Asked Questions

What is the IUPAC name of [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine?
The IUPAC name of [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine (CID 95220358) is [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine.
What is the SMILES notation for [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine?
The canonical SMILES for [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine is NC[C@H]1Cc2cccc(-c3ccc4[nH]ccc4c3)c2O1.
What is the InChIKey of [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine?
The InChIKey is FJJVPHHQYJTRAZ-CQSZACIVSA-N. The full InChI is InChI=1S/C17H16N2O/c18-10-14-9-13-2-1-3-15(17(13)20-14)11-4-5-16-12(8-11)6-7-19-16/h1-8,14,19H,9-10,18H2/t14-/m1/s1.
What are the key properties of [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine?
[(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine has a molecular weight of 264.33 g/mol, XLogP of 3.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-7-(1H-indol-5-yl)-2,3-dihydro-1-benzofuran-2-yl]methanamine is sourced from PubChem (CID 95220358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).