N-(4-chlorophenyl)cyclopentanecarboxamide

C12H14ClNO — CID 849228

IUPACN-(4-chlorophenyl)cyclopentanecarboxamide
SMILESO=C(Nc1ccc(Cl)cc1)C1CCCC1
InChIInChI=1S/C12H14ClNO/c13-10-5-7-11(8-6-10)14-12(15)9-3-1-2-4-9/h5-9H,1-4H2,(H,14,15)
InChIKeyZJVORKOWFIWCLT-UHFFFAOYSA-N
MW223.70 g/mol
LogP3.47
Rot. Bonds2

About N-(4-chlorophenyl)cyclopentanecarboxamide

N-(4-chlorophenyl)cyclopentanecarboxamide (PubChem CID 849228) has the molecular formula C12H14ClNO and a molecular weight of 223.70 g/mol. Its IUPAC name is N-(4-chlorophenyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)cyclopentanecarboxamide
PubChem CID849228
Molecular FormulaC12H14ClNO
Molecular Weight223.70 g/mol
Exact Mass223.08
IUPAC NameN-(4-chlorophenyl)cyclopentanecarboxamide
SMILESO=C(Nc1ccc(Cl)cc1)C1CCCC1
InChIInChI=1S/C12H14ClNO/c13-10-5-7-11(8-6-10)14-12(15)9-3-1-2-4-9/h5-9H,1-4H2,(H,14,15)
InChIKeyZJVORKOWFIWCLT-UHFFFAOYSA-N
XLogP3.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.70
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)cyclopentanecarboxamide?
The IUPAC name of N-(4-chlorophenyl)cyclopentanecarboxamide (CID 849228) is N-(4-chlorophenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(4-chlorophenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(4-chlorophenyl)cyclopentanecarboxamide is O=C(Nc1ccc(Cl)cc1)C1CCCC1.
What is the InChIKey of N-(4-chlorophenyl)cyclopentanecarboxamide?
The InChIKey is ZJVORKOWFIWCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClNO/c13-10-5-7-11(8-6-10)14-12(15)9-3-1-2-4-9/h5-9H,1-4H2,(H,14,15).
What are the key properties of N-(4-chlorophenyl)cyclopentanecarboxamide?
N-(4-chlorophenyl)cyclopentanecarboxamide has a molecular weight of 223.70 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)cyclopentanecarboxamide is sourced from PubChem (CID 849228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).