N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide

C17H19NO2 — CID 769060

IUPACN-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide
SMILESO=C(NCc1ccco1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C17H19NO2/c19-16(18-13-15-9-6-12-20-15)17(10-4-5-11-17)14-7-2-1-3-8-14/h1-3,6-9,12H,4-5,10-11,13H2,(H,18,19)
InChIKeyUYHUDHREVYGIJR-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.41
Rot. Bonds4

About N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide

N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide (PubChem CID 769060) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide
PubChem CID769060
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide
SMILESO=C(NCc1ccco1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C17H19NO2/c19-16(18-13-15-9-6-12-20-15)17(10-4-5-11-17)14-7-2-1-3-8-14/h1-3,6-9,12H,4-5,10-11,13H2,(H,18,19)
InChIKeyUYHUDHREVYGIJR-UHFFFAOYSA-N
XLogP3.41
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide (CID 769060) is N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide is O=C(NCc1ccco1)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide?
The InChIKey is UYHUDHREVYGIJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c19-16(18-13-15-9-6-12-20-15)17(10-4-5-11-17)14-7-2-1-3-8-14/h1-3,6-9,12H,4-5,10-11,13H2,(H,18,19).
What are the key properties of N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide?
N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide has a molecular weight of 269.34 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 769060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).