2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide

C20H22ClNO3 — CID 132654197

IUPAC2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)Nc1ccc(OC2CCCC2)cc1
InChIInChI=1S/C20H22ClNO3/c1-14(24-19-9-5-4-8-18(19)21)20(23)22-15-10-12-17(13-11-15)25-16-6-2-3-7-16/h4-5,8-14,16H,2-3,6-7H2,1H3,(H,22,23)
InChIKeyZQYJPXNSJTXOSQ-UHFFFAOYSA-N
MW359.85 g/mol
LogP5.07
Rot. Bonds6

About 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide

2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide (PubChem CID 132654197) has the molecular formula C20H22ClNO3 and a molecular weight of 359.85 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide
PubChem CID132654197
Molecular FormulaC20H22ClNO3
Molecular Weight359.85 g/mol
Exact Mass359.13
IUPAC Name2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)Nc1ccc(OC2CCCC2)cc1
InChIInChI=1S/C20H22ClNO3/c1-14(24-19-9-5-4-8-18(19)21)20(23)22-15-10-12-17(13-11-15)25-16-6-2-3-7-16/h4-5,8-14,16H,2-3,6-7H2,1H3,(H,22,23)
InChIKeyZQYJPXNSJTXOSQ-UHFFFAOYSA-N
XLogP5.07
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.85
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chlorophenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
CID 17340245
2-(2-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]propanamide
CID 42990289
4-[2-(2-chlorophenoxy)propanoylamino]-N-cyclohexylbenzamide
CID 43878541
(2S)-2-(2-chlorophenoxy)-N-[4-(2-methylpropoxy)phenyl]propanamide
CID 8757745
(2R)-2-(2-chlorophenoxy)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 39126898
2-(2-chloro-4-fluorophenoxy)-N-[4-(1-methylpiperidin-4-yl)oxyphenyl]propanamide
CID 131943396
(2R)-2-(2-chlorophenoxy)-N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]propanamide
CID 9295727
(2S)-2-(2-methoxyphenoxy)-N-[4-(1-methylpiperidin-4-yl)oxyphenyl]propanamide
CID 99972736
(2S)-2-(2-ethylphenoxy)-N-[4-(1-methylpiperidin-4-yl)oxyphenyl]propanamide
CID 99972529
(2S)-2-(2-chlorophenoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 7816093
(2R)-2-(2-chlorophenoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 7816091
N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide
CID 46579795

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide (CID 132654197) is 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide is CC(Oc1ccccc1Cl)C(=O)Nc1ccc(OC2CCCC2)cc1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide?
The InChIKey is ZQYJPXNSJTXOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClNO3/c1-14(24-19-9-5-4-8-18(19)21)20(23)22-15-10-12-17(13-11-15)25-16-6-2-3-7-16/h4-5,8-14,16H,2-3,6-7H2,1H3,(H,22,23).
What are the key properties of 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide?
2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide has a molecular weight of 359.85 g/mol, XLogP of 5.07, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-(4-cyclopentyloxyphenyl)propanamide is sourced from PubChem (CID 132654197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).