2-(4-chlorophenoxy)-N-cyclopentylbutanamide

C15H20ClNO2 — CID 6473403

IUPAC2-(4-chlorophenoxy)-N-cyclopentylbutanamide
SMILESCCC(Oc1ccc(Cl)cc1)C(=O)NC1CCCC1
InChIInChI=1S/C15H20ClNO2/c1-2-14(15(18)17-12-5-3-4-6-12)19-13-9-7-11(16)8-10-13/h7-10,12,14H,2-6H2,1H3,(H,17,18)
InChIKeyDEAPTSOZXZKLAP-UHFFFAOYSA-N
MW281.78 g/mol
LogP3.56
Rot. Bonds5

About 2-(4-chlorophenoxy)-N-cyclopentylbutanamide

2-(4-chlorophenoxy)-N-cyclopentylbutanamide (PubChem CID 6473403) has the molecular formula C15H20ClNO2 and a molecular weight of 281.78 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-cyclopentylbutanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-cyclopentylbutanamide
PubChem CID6473403
Molecular FormulaC15H20ClNO2
Molecular Weight281.78 g/mol
Exact Mass281.12
IUPAC Name2-(4-chlorophenoxy)-N-cyclopentylbutanamide
SMILESCCC(Oc1ccc(Cl)cc1)C(=O)NC1CCCC1
InChIInChI=1S/C15H20ClNO2/c1-2-14(15(18)17-12-5-3-4-6-12)19-13-9-7-11(16)8-10-13/h7-10,12,14H,2-6H2,1H3,(H,17,18)
InChIKeyDEAPTSOZXZKLAP-UHFFFAOYSA-N
XLogP3.56
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.78
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-cyclopentylbutanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-cyclopentylbutanamide (CID 6473403) is 2-(4-chlorophenoxy)-N-cyclopentylbutanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-cyclopentylbutanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-cyclopentylbutanamide is CCC(Oc1ccc(Cl)cc1)C(=O)NC1CCCC1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-cyclopentylbutanamide?
The InChIKey is DEAPTSOZXZKLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO2/c1-2-14(15(18)17-12-5-3-4-6-12)19-13-9-7-11(16)8-10-13/h7-10,12,14H,2-6H2,1H3,(H,17,18).
What are the key properties of 2-(4-chlorophenoxy)-N-cyclopentylbutanamide?
2-(4-chlorophenoxy)-N-cyclopentylbutanamide has a molecular weight of 281.78 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-cyclopentylbutanamide is sourced from PubChem (CID 6473403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).