N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide

C17H19NO2 — CID 739189

IUPACN-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide
SMILESO=C(NCC1(c2ccccc2)CCCC1)c1ccco1
InChIInChI=1S/C17H19NO2/c19-16(15-9-6-12-20-15)18-13-17(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)
InChIKeyRMKLKVBHIHPRSH-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.52
Rot. Bonds4

About N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide

N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide (PubChem CID 739189) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide
PubChem CID739189
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide
SMILESO=C(NCC1(c2ccccc2)CCCC1)c1ccco1
InChIInChI=1S/C17H19NO2/c19-16(15-9-6-12-20-15)18-13-17(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)
InChIKeyRMKLKVBHIHPRSH-UHFFFAOYSA-N
XLogP3.52
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 ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide?
The IUPAC name of N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide (CID 739189) is N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide?
The canonical SMILES for N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide is O=C(NCC1(c2ccccc2)CCCC1)c1ccco1.
What is the InChIKey of N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide?
The InChIKey is RMKLKVBHIHPRSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c19-16(15-9-6-12-20-15)18-13-17(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-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide?
N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide has a molecular weight of 269.34 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-phenylcyclopentyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 739189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).