N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide

C15H20ClN3O2 — CID 60801057

IUPACN-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide
SMILESNC(=O)CN(C(=O)Cc1ccc(Cl)cc1)C1CCNCC1
InChIInChI=1S/C15H20ClN3O2/c16-12-3-1-11(2-4-12)9-15(21)19(10-14(17)20)13-5-7-18-8-6-13/h1-4,13,18H,5-10H2,(H2,17,20)
InChIKeyPJXONKVRWIWNIV-UHFFFAOYSA-N
MW309.80 g/mol
LogP0.95
Rot. Bonds5

About N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide

N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide (PubChem CID 60801057) has the molecular formula C15H20ClN3O2 and a molecular weight of 309.80 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide
PubChem CID60801057
Molecular FormulaC15H20ClN3O2
Molecular Weight309.80 g/mol
Exact Mass309.12
IUPAC NameN-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide
SMILESNC(=O)CN(C(=O)Cc1ccc(Cl)cc1)C1CCNCC1
InChIInChI=1S/C15H20ClN3O2/c16-12-3-1-11(2-4-12)9-15(21)19(10-14(17)20)13-5-7-18-8-6-13/h1-4,13,18H,5-10H2,(H2,17,20)
InChIKeyPJXONKVRWIWNIV-UHFFFAOYSA-N
XLogP0.95
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-N-ethyl-N-piperidin-4-ylacetamide
CID 60806745
N,2-bis(4-chlorophenyl)-N-piperidin-4-ylacetamide
CID 23338995
N-(2-amino-2-oxoethyl)-5-chloro-N-piperidin-4-ylfuran-2-carboxamide
CID 54923700
2-[4-(aminomethyl)phenyl]-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide
CID 63589438
N-(2-amino-2-oxoethyl)-N-cyclopentyl-2-(4-sulfanylphenyl)acetamide
CID 107026216
N-(2-amino-2-oxoethyl)-2-(2-fluorophenyl)-N-pyrrolidin-3-ylacetamide
CID 60806860
N-(2-amino-2-oxoethyl)-N-piperidin-4-yl-3-pyridin-4-ylpropanamide
CID 114289948
2-[(3-chloro-4-fluorophenyl)methyl-piperidin-4-ylamino]acetamide
CID 103038748
2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)acetamide
CID 43576750
N-[(2,4-dichlorophenyl)methyl]-2-(4-methoxyphenyl)-N-piperidin-4-ylacetamide
CID 10223070
N-(3-amino-3-hydroxyiminopropyl)-2-(4-chlorophenyl)-N-cyclopropylacetamide
CID 76911867
N-(2-chloroethyl)-2-(4-chlorophenyl)-N-cyclohexylacetamide
CID 63391287

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide (CID 60801057) is N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide is NC(=O)CN(C(=O)Cc1ccc(Cl)cc1)C1CCNCC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide?
The InChIKey is PJXONKVRWIWNIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O2/c16-12-3-1-11(2-4-12)9-15(21)19(10-14(17)20)13-5-7-18-8-6-13/h1-4,13,18H,5-10H2,(H2,17,20).
What are the key properties of N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide?
N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide has a molecular weight of 309.80 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-(4-chlorophenyl)-N-piperidin-4-ylacetamide is sourced from PubChem (CID 60801057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).