2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide

C17H23N3O3 — CID 78773400

IUPAC2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
SMILESCC(=O)NC(C)C(=O)Nc1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C17H23N3O3/c1-12(18-13(2)21)16(22)19-15-9-5-4-8-14(15)17(23)20-10-6-3-7-11-20/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyNXQORFNPVWGGOI-UHFFFAOYSA-N
MW317.39 g/mol
LogP1.78
Rot. Bonds4

About 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide

2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide (PubChem CID 78773400) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide.

Molecular Properties

Compound Name2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
PubChem CID78773400
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Name2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
SMILESCC(=O)NC(C)C(=O)Nc1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C17H23N3O3/c1-12(18-13(2)21)16(22)19-15-9-5-4-8-14(15)17(23)20-10-6-3-7-11-20/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyNXQORFNPVWGGOI-UHFFFAOYSA-N
XLogP1.78
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,3-dimethyl-N-[(2R)-1-oxo-1-[2-(pyrrolidine-1-carbonyl)anilino]propan-2-yl]butanamide
CID 99824360
2,2-diphenyl-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 1341137
(2S)-2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
CID 40796739
2,2-diphenyl-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 1272938
(2R)-2-(4-methylphenoxy)-N-[2-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 40796627
2-(2,6-dimethylphenoxy)-N-[2-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 4958532
(2R)-2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
CID 28637146
(2S)-N-[2-(azepane-1-carbonyl)phenyl]-2-(2,3-dimethylphenoxy)propanamide
CID 94012360
2-(3-methylphenoxy)-N-[2-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 5138482
methyl N-[2-(pyrrolidine-1-carbonyl)phenyl]carbamate
CID 551078
1-N,4-N-bis[2-(azepane-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 4938376
N-[2-(azepane-1-carbonyl)phenyl]-2-(4-nitrophenoxy)propanamide
CID 4951317

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide?
The IUPAC name of 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide (CID 78773400) is 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide.
What is the SMILES notation for 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide?
The canonical SMILES for 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide is CC(=O)NC(C)C(=O)Nc1ccccc1C(=O)N1CCCCC1.
What is the InChIKey of 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide?
The InChIKey is NXQORFNPVWGGOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-12(18-13(2)21)16(22)19-15-9-5-4-8-14(15)17(23)20-10-6-3-7-11-20/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3,(H,18,21)(H,19,22).
What are the key properties of 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide?
2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide has a molecular weight of 317.39 g/mol, XLogP of 1.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[2-(piperidine-1-carbonyl)phenyl]propanamide is sourced from PubChem (CID 78773400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).