2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide

C22H25ClN2O4 — CID 108553138

IUPAC2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide
SMILESCOc1ccccc1C(=O)N1CCC(NC(=O)C(C)Oc2ccc(Cl)cc2)CC1
InChIInChI=1S/C22H25ClN2O4/c1-15(29-18-9-7-16(23)8-10-18)21(26)24-17-11-13-25(14-12-17)22(27)19-5-3-4-6-20(19)28-2/h3-10,15,17H,11-14H2,1-2H3,(H,24,26)
InChIKeyFPRCMMYGZCMEEY-UHFFFAOYSA-N
MW416.91 g/mol
LogP3.54
Rot. Bonds6

About 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide

2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide (PubChem CID 108553138) has the molecular formula C22H25ClN2O4 and a molecular weight of 416.91 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide
PubChem CID108553138
Molecular FormulaC22H25ClN2O4
Molecular Weight416.91 g/mol
Exact Mass416.15
IUPAC Name2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide
SMILESCOc1ccccc1C(=O)N1CCC(NC(=O)C(C)Oc2ccc(Cl)cc2)CC1
InChIInChI=1S/C22H25ClN2O4/c1-15(29-18-9-7-16(23)8-10-18)21(26)24-17-11-13-25(14-12-17)22(27)19-5-3-4-6-20(19)28-2/h3-10,15,17H,11-14H2,1-2H3,(H,24,26)
InChIKeyFPRCMMYGZCMEEY-UHFFFAOYSA-N
XLogP3.54
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.91
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenoxy)-N-[1-(2-fluorobenzoyl)piperidin-4-yl]propanamide
CID 55703255
N-[1-(3-chlorobenzoyl)piperidin-4-yl]-2-(4-chlorophenoxy)propanamide
CID 108553149
N-[1-(4-chlorobenzoyl)piperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108551143
N-[1-(2,5-dichlorobenzoyl)piperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108551181
2-chloro-N-[1-(2-methoxybenzoyl)piperidin-4-yl]acetamide
CID 108563596
2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide
CID 108553182
1-cyclohexyl-3-[1-(2-methoxybenzoyl)piperidin-4-yl]urea
CID 127232346
N-[1-(2-methoxybenzoyl)piperidin-4-yl]-2-(2-methoxyphenoxy)acetamide
CID 108556653
2-(4-chlorophenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]propanamide
CID 24504184
2-chloro-6-fluoro-N-[1-(2-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108558620
3,5-dimethoxy-N-[1-(2-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108550564
N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110820511

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide (CID 108553138) is 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide is COc1ccccc1C(=O)N1CCC(NC(=O)C(C)Oc2ccc(Cl)cc2)CC1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide?
The InChIKey is FPRCMMYGZCMEEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25ClN2O4/c1-15(29-18-9-7-16(23)8-10-18)21(26)24-17-11-13-25(14-12-17)22(27)19-5-3-4-6-20(19)28-2/h3-10,15,17H,11-14H2,1-2H3,(H,24,26).
What are the key properties of 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide?
2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide has a molecular weight of 416.91 g/mol, XLogP of 3.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 108553138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).