N-(3-methylphenyl)cyclopentanecarboxamide

C13H17NO — CID 531884

IUPACN-(3-methylphenyl)cyclopentanecarboxamide
SMILESCc1cccc(NC(=O)C2CCCC2)c1
InChIInChI=1S/C13H17NO/c1-10-5-4-8-12(9-10)14-13(15)11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyUKLIDCZVVSZTGM-UHFFFAOYSA-N
MW203.29 g/mol
LogP3.12
Rot. Bonds2

About N-(3-methylphenyl)cyclopentanecarboxamide

N-(3-methylphenyl)cyclopentanecarboxamide (PubChem CID 531884) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is N-(3-methylphenyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)cyclopentanecarboxamide
PubChem CID531884
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC NameN-(3-methylphenyl)cyclopentanecarboxamide
SMILESCc1cccc(NC(=O)C2CCCC2)c1
InChIInChI=1S/C13H17NO/c1-10-5-4-8-12(9-10)14-13(15)11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyUKLIDCZVVSZTGM-UHFFFAOYSA-N
XLogP3.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)cyclopentanecarboxamide?
The IUPAC name of N-(3-methylphenyl)cyclopentanecarboxamide (CID 531884) is N-(3-methylphenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(3-methylphenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(3-methylphenyl)cyclopentanecarboxamide is Cc1cccc(NC(=O)C2CCCC2)c1.
What is the InChIKey of N-(3-methylphenyl)cyclopentanecarboxamide?
The InChIKey is UKLIDCZVVSZTGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-10-5-4-8-12(9-10)14-13(15)11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7H2,1H3,(H,14,15).
What are the key properties of N-(3-methylphenyl)cyclopentanecarboxamide?
N-(3-methylphenyl)cyclopentanecarboxamide has a molecular weight of 203.29 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)cyclopentanecarboxamide is sourced from PubChem (CID 531884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).