2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide

C25H27N3O2 — CID 54843036

IUPAC2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide
SMILESCC1CCN(C(=O)c2cccc(NCC(=O)Nc3ccc4ccccc4c3)c2)CC1
InChIInChI=1S/C25H27N3O2/c1-18-11-13-28(14-12-18)25(30)21-7-4-8-22(16-21)26-17-24(29)27-23-10-9-19-5-2-3-6-20(19)15-23/h2-10,15-16,18,26H,11-14,17H2,1H3,(H,27,29)
InChIKeyVPCARWSGGUWSCC-UHFFFAOYSA-N
MW401.51 g/mol
LogP4.76
Rot. Bonds5

About 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide

2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide (PubChem CID 54843036) has the molecular formula C25H27N3O2 and a molecular weight of 401.51 g/mol. Its IUPAC name is 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide.

Molecular Properties

Compound Name2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide
PubChem CID54843036
Molecular FormulaC25H27N3O2
Molecular Weight401.51 g/mol
Exact Mass401.21
IUPAC Name2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide
SMILESCC1CCN(C(=O)c2cccc(NCC(=O)Nc3ccc4ccccc4c3)c2)CC1
InChIInChI=1S/C25H27N3O2/c1-18-11-13-28(14-12-18)25(30)21-7-4-8-22(16-21)26-17-24(29)27-23-10-9-19-5-2-3-6-20(19)15-23/h2-10,15-16,18,26H,11-14,17H2,1H3,(H,27,29)
InChIKeyVPCARWSGGUWSCC-UHFFFAOYSA-N
XLogP4.76
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.51
LogP ≤ 54.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide 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-anilino-N-[3-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54810526
N-(4-methoxyphenyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
CID 54843609
N-(4-acetamidophenyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
CID 54843300
N-[4-(4-methylpiperidine-1-carbonyl)phenyl]-2-[3-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 54841292
2-(4-fluoroanilino)-N-[3-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54813298
N-[3-(4-methylpiperidine-1-carbonyl)phenyl]-2-[4-(piperidine-1-carbonyl)anilino]acetamide
CID 54841357
2-[3-(azepane-1-carbonyl)anilino]-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54841463
N-[3-(4-methylpiperidine-1-carbonyl)phenyl]-2-[4-(2-phenoxyethoxy)anilino]acetamide
CID 54822959
N-(4-ethoxyphenyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
CID 54843517
2-(3,5-dichloroanilino)-N-[3-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54813365
N-[3-(4-methylpiperidine-1-carbonyl)phenyl]-2-(2-propan-2-ylanilino)acetamide
CID 54823206
2-(2-bromoanilino)-N-[3-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54816568

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide?
The IUPAC name of 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide (CID 54843036) is 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide.
What is the SMILES notation for 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide?
The canonical SMILES for 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide is CC1CCN(C(=O)c2cccc(NCC(=O)Nc3ccc4ccccc4c3)c2)CC1.
What is the InChIKey of 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide?
The InChIKey is VPCARWSGGUWSCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N3O2/c1-18-11-13-28(14-12-18)25(30)21-7-4-8-22(16-21)26-17-24(29)27-23-10-9-19-5-2-3-6-20(19)15-23/h2-10,15-16,18,26H,11-14,17H2,1H3,(H,27,29).
What are the key properties of 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide?
2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide has a molecular weight of 401.51 g/mol, XLogP of 4.76, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-naphthalen-2-ylacetamide is sourced from PubChem (CID 54843036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).