N-(4-methoxyphenyl)cyclopentanecarboxamide

C13H17NO2 — CID 531886

IUPACN-(4-methoxyphenyl)cyclopentanecarboxamide
SMILESCOc1ccc(NC(=O)C2CCCC2)cc1
InChIInChI=1S/C13H17NO2/c1-16-12-8-6-11(7-9-12)14-13(15)10-4-2-3-5-10/h6-10H,2-5H2,1H3,(H,14,15)
InChIKeyYKQPMEUETFVVNA-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.82
Rot. Bonds3

About N-(4-methoxyphenyl)cyclopentanecarboxamide

N-(4-methoxyphenyl)cyclopentanecarboxamide (PubChem CID 531886) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is N-(4-methoxyphenyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)cyclopentanecarboxamide
PubChem CID531886
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC NameN-(4-methoxyphenyl)cyclopentanecarboxamide
SMILESCOc1ccc(NC(=O)C2CCCC2)cc1
InChIInChI=1S/C13H17NO2/c1-16-12-8-6-11(7-9-12)14-13(15)10-4-2-3-5-10/h6-10H,2-5H2,1H3,(H,14,15)
InChIKeyYKQPMEUETFVVNA-UHFFFAOYSA-N
XLogP2.82
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)cyclopentanecarboxamide?
The IUPAC name of N-(4-methoxyphenyl)cyclopentanecarboxamide (CID 531886) is N-(4-methoxyphenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(4-methoxyphenyl)cyclopentanecarboxamide is COc1ccc(NC(=O)C2CCCC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)cyclopentanecarboxamide?
The InChIKey is YKQPMEUETFVVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-16-12-8-6-11(7-9-12)14-13(15)10-4-2-3-5-10/h6-10H,2-5H2,1H3,(H,14,15).
What are the key properties of N-(4-methoxyphenyl)cyclopentanecarboxamide?
N-(4-methoxyphenyl)cyclopentanecarboxamide has a molecular weight of 219.28 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)cyclopentanecarboxamide is sourced from PubChem (CID 531886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).