2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide

C18H25ClN2O4 — CID 108553182

IUPAC2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide
SMILESCOCCC(=O)N1CCC(NC(=O)C(C)Oc2ccc(Cl)cc2)CC1
InChIInChI=1S/C18H25ClN2O4/c1-13(25-16-5-3-14(19)4-6-16)18(23)20-15-7-10-21(11-8-15)17(22)9-12-24-2/h3-6,13,15H,7-12H2,1-2H3,(H,20,23)
InChIKeyYQOTTYVUMLNHPE-UHFFFAOYSA-N
MW368.86 g/mol
LogP2.25
Rot. Bonds7

About 2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide

2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide (PubChem CID 108553182) has the molecular formula C18H25ClN2O4 and a molecular weight of 368.86 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide
PubChem CID108553182
Molecular FormulaC18H25ClN2O4
Molecular Weight368.86 g/mol
Exact Mass368.15
IUPAC Name2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide
SMILESCOCCC(=O)N1CCC(NC(=O)C(C)Oc2ccc(Cl)cc2)CC1
InChIInChI=1S/C18H25ClN2O4/c1-13(25-16-5-3-14(19)4-6-16)18(23)20-15-7-10-21(11-8-15)17(22)9-12-24-2/h3-6,13,15H,7-12H2,1-2H3,(H,20,23)
InChIKeyYQOTTYVUMLNHPE-UHFFFAOYSA-N
XLogP2.25
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.86
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[3-[4-[2-(4-chlorophenoxy)propanoylamino]piperidin-1-yl]-3-oxopropyl]carbamate
CID 108919633
N-[1-(3-chloropropanoyl)piperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108560062
N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide
CID 108553340
2-(4-chlorophenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]propanamide
CID 24504184
2-chloro-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide
CID 108566430
N-[1-(4-chlorobenzoyl)piperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108551143
2-(4-chlorophenoxy)-N-[1-[2-(2,4-dimethylphenoxy)acetyl]piperidin-4-yl]propanamide
CID 108553151
2-(4-chlorophenoxy)-N-[1-(2-methoxybenzoyl)piperidin-4-yl]propanamide
CID 108553138
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
3-methoxy-N-[1-[2-(4-propan-2-ylphenoxy)propanoyl]piperidin-4-yl]propanamide
CID 108556193
N-[1-[2-(4-chlorophenoxy)propanoyl]piperidin-4-yl]-4-oxopentanamide
CID 108558057

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide (CID 108553182) is 2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide is COCCC(=O)N1CCC(NC(=O)C(C)Oc2ccc(Cl)cc2)CC1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide?
The InChIKey is YQOTTYVUMLNHPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25ClN2O4/c1-13(25-16-5-3-14(19)4-6-16)18(23)20-15-7-10-21(11-8-15)17(22)9-12-24-2/h3-6,13,15H,7-12H2,1-2H3,(H,20,23).
What are the key properties of 2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide?
2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide has a molecular weight of 368.86 g/mol, XLogP of 2.25, 7 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-(3-methoxypropanoyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 108553182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).