N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide

C22H20ClN3O2 — CID 138687757

IUPACN-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide
SMILESO=C(Nc1ccc(Cl)cn1)C(=O)N1CCC(c2cccc3ccccc23)CC1
InChIInChI=1S/C22H20ClN3O2/c23-17-8-9-20(24-14-17)25-21(27)22(28)26-12-10-16(11-13-26)19-7-3-5-15-4-1-2-6-18(15)19/h1-9,14,16H,10-13H2,(H,24,25,27)
InChIKeyKLNALXKKZIHZPA-UHFFFAOYSA-N
MW393.87 g/mol
LogP4.23
Rot. Bonds2

About N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide

N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide (PubChem CID 138687757) has the molecular formula C22H20ClN3O2 and a molecular weight of 393.87 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide
PubChem CID138687757
Molecular FormulaC22H20ClN3O2
Molecular Weight393.87 g/mol
Exact Mass393.12
IUPAC NameN-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide
SMILESO=C(Nc1ccc(Cl)cn1)C(=O)N1CCC(c2cccc3ccccc23)CC1
InChIInChI=1S/C22H20ClN3O2/c23-17-8-9-20(24-14-17)25-21(27)22(28)26-12-10-16(11-13-26)19-7-3-5-15-4-1-2-6-18(15)19/h1-9,14,16H,10-13H2,(H,24,25,27)
InChIKeyKLNALXKKZIHZPA-UHFFFAOYSA-N
XLogP4.23
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.87
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-[2-(aminomethyl)phenyl]piperidin-1-yl]-N-isoquinolin-4-yl-2-oxoacetamide
CID 166292060
N-(1-benzoylpiperidin-4-yl)-N'-(5-chloro-2-pyridinyl)oxamide
CID 142691795
N-(5-chloro-2-pyridinyl)-2-oxo-2-spiro[2H-1-benzofuran-3,4'-piperidine]-1'-ylacetamide
CID 139295389
N-(5-chloro-2-pyridinyl)-2-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanylacetamide
CID 9456862
(4-amino-1-bicyclo[2.2.2]octanyl)-(3-naphthalen-1-ylpyrrolidin-1-yl)methanone
CID 166303264
4-N-(5-chloro-2-pyridinyl)-1-N-phenylpiperidine-1,4-dicarboxamide
CID 51180162
1-(3-aminopropanoyl)-N-(5-chloro-2-pyridinyl)piperidine-4-carboxamide;dihydrochloride
CID 119856586
N-(5-chloro-2-pyridinyl)-1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide
CID 55813160
N-(5-chloro-2-pyridinyl)-1-[(4-methylquinazolin-2-yl)methyl]piperidine-4-carboxamide
CID 87021618
1-(5-chloro-2-pyridinyl)-3-naphthalen-1-ylthiourea
CID 19686288
2-[(5-chloro-2-pyridinyl)amino]-2-oxoacetyl chloride
CID 152602540
N-(5-chloro-2-pyridinyl)-2-[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]acetamide
CID 943818

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide (CID 138687757) is N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide is O=C(Nc1ccc(Cl)cn1)C(=O)N1CCC(c2cccc3ccccc23)CC1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide?
The InChIKey is KLNALXKKZIHZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClN3O2/c23-17-8-9-20(24-14-17)25-21(27)22(28)26-12-10-16(11-13-26)19-7-3-5-15-4-1-2-6-18(15)19/h1-9,14,16H,10-13H2,(H,24,25,27).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide?
N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide has a molecular weight of 393.87 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-(4-naphthalen-1-ylpiperidin-1-yl)-2-oxoacetamide is sourced from PubChem (CID 138687757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).