N-(1-benzofuran-2-ylmethyl)cyclopentanamine

C14H17NO — CID 28610923

IUPACN-(1-benzofuran-2-ylmethyl)cyclopentanamine
SMILESc1ccc2oc(CNC3CCCC3)cc2c1
InChIInChI=1S/C14H17NO/c1-4-8-14-11(5-1)9-13(16-14)10-15-12-6-2-3-7-12/h1,4-5,8-9,12,15H,2-3,6-7,10H2
InChIKeyINZATFLOOKNDKK-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.46
Rot. Bonds3

About N-(1-benzofuran-2-ylmethyl)cyclopentanamine

N-(1-benzofuran-2-ylmethyl)cyclopentanamine (PubChem CID 28610923) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is N-(1-benzofuran-2-ylmethyl)cyclopentanamine.

Molecular Properties

Compound NameN-(1-benzofuran-2-ylmethyl)cyclopentanamine
PubChem CID28610923
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC NameN-(1-benzofuran-2-ylmethyl)cyclopentanamine
SMILESc1ccc2oc(CNC3CCCC3)cc2c1
InChIInChI=1S/C14H17NO/c1-4-8-14-11(5-1)9-13(16-14)10-15-12-6-2-3-7-12/h1,4-5,8-9,12,15H,2-3,6-7,10H2
InChIKeyINZATFLOOKNDKK-UHFFFAOYSA-N
XLogP3.46
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 ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzofuran-2-ylmethyl)cyclopentanamine?
The IUPAC name of N-(1-benzofuran-2-ylmethyl)cyclopentanamine (CID 28610923) is N-(1-benzofuran-2-ylmethyl)cyclopentanamine.
What is the SMILES notation for N-(1-benzofuran-2-ylmethyl)cyclopentanamine?
The canonical SMILES for N-(1-benzofuran-2-ylmethyl)cyclopentanamine is c1ccc2oc(CNC3CCCC3)cc2c1.
What is the InChIKey of N-(1-benzofuran-2-ylmethyl)cyclopentanamine?
The InChIKey is INZATFLOOKNDKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-4-8-14-11(5-1)9-13(16-14)10-15-12-6-2-3-7-12/h1,4-5,8-9,12,15H,2-3,6-7,10H2.
What are the key properties of N-(1-benzofuran-2-ylmethyl)cyclopentanamine?
N-(1-benzofuran-2-ylmethyl)cyclopentanamine has a molecular weight of 215.30 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzofuran-2-ylmethyl)cyclopentanamine is sourced from PubChem (CID 28610923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).