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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Related Compounds

N-(1-benzofuran-2-ylmethyl)-2-methylcyclohexan-1-amine
CID 43080449
N-(1-benzofuran-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 55386970
N-(1-benzofuran-2-ylmethyl)-1-methylpyrrolidin-3-amine
CID 54950067
(3R)-N-(1-benzofuran-2-ylmethyl)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-amine
CID 51901465
2-[4-(1-benzofuran-2-ylmethylamino)piperidin-1-yl]acetamide
CID 43433116
2-[(cyclopropylamino)methyl]-1-benzofuran-6-amine
CID 117179242
2-[(cyclobutylamino)methyl]-1-benzofuran-7-ol
CID 117182713
N-(1-benzofuran-2-ylmethyl)-2-cyclohexylethanamine
CID 63448343
N-(1-benzofuran-2-ylmethyl)-1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-amine
CID 119111019
N-[(5-phenoxy-1-benzofuran-2-yl)methyl]cyclopropanamine
CID 65440151
N-(1-benzofuran-2-ylmethyl)-2-cyclohexyloxyacetamide
CID 87001290
N-(1-benzofuran-2-ylmethyl)-2-cyclopropylpropan-1-amine
CID 115592636

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).