[1-(1-benzofuran-3-yl)cyclopentyl]methanamine

C14H17NO — CID 82613639

IUPAC[1-(1-benzofuran-3-yl)cyclopentyl]methanamine
SMILESNCC1(c2coc3ccccc23)CCCC1
InChIInChI=1S/C14H17NO/c15-10-14(7-3-4-8-14)12-9-16-13-6-2-1-5-11(12)13/h1-2,5-6,9H,3-4,7-8,10,15H2
InChIKeyMYJVDEYBPOMMMU-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.20
Rot. Bonds2

About [1-(1-benzofuran-3-yl)cyclopentyl]methanamine

[1-(1-benzofuran-3-yl)cyclopentyl]methanamine (PubChem CID 82613639) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is [1-(1-benzofuran-3-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(1-benzofuran-3-yl)cyclopentyl]methanamine
PubChem CID82613639
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name[1-(1-benzofuran-3-yl)cyclopentyl]methanamine
SMILESNCC1(c2coc3ccccc23)CCCC1
InChIInChI=1S/C14H17NO/c15-10-14(7-3-4-8-14)12-9-16-13-6-2-1-5-11(12)13/h1-2,5-6,9H,3-4,7-8,10,15H2
InChIKeyMYJVDEYBPOMMMU-UHFFFAOYSA-N
XLogP3.20
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(1-benzofuran-3-yl)cyclopentyl]methanamine?
The IUPAC name of [1-(1-benzofuran-3-yl)cyclopentyl]methanamine (CID 82613639) is [1-(1-benzofuran-3-yl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(1-benzofuran-3-yl)cyclopentyl]methanamine?
The canonical SMILES for [1-(1-benzofuran-3-yl)cyclopentyl]methanamine is NCC1(c2coc3ccccc23)CCCC1.
What is the InChIKey of [1-(1-benzofuran-3-yl)cyclopentyl]methanamine?
The InChIKey is MYJVDEYBPOMMMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c15-10-14(7-3-4-8-14)12-9-16-13-6-2-1-5-11(12)13/h1-2,5-6,9H,3-4,7-8,10,15H2.
What are the key properties of [1-(1-benzofuran-3-yl)cyclopentyl]methanamine?
[1-(1-benzofuran-3-yl)cyclopentyl]methanamine has a molecular weight of 215.30 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-benzofuran-3-yl)cyclopentyl]methanamine is sourced from PubChem (CID 82613639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).