N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide

C17H24N2O2 — CID 150565764

IUPACN-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide
SMILESCC(=O)N(C(=O)CN1CC(C)CC(C)C1)c1ccccc1
InChIInChI=1S/C17H24N2O2/c1-13-9-14(2)11-18(10-13)12-17(21)19(15(3)20)16-7-5-4-6-8-16/h4-8,13-14H,9-12H2,1-3H3
InChIKeyIKUMSDVGMHYHEI-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.54
Rot. Bonds3

About N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide

N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide (PubChem CID 150565764) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide.

Molecular Properties

Compound NameN-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide
PubChem CID150565764
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide
SMILESCC(=O)N(C(=O)CN1CC(C)CC(C)C1)c1ccccc1
InChIInChI=1S/C17H24N2O2/c1-13-9-14(2)11-18(10-13)12-17(21)19(15(3)20)16-7-5-4-6-8-16/h4-8,13-14H,9-12H2,1-3H3
InChIKeyIKUMSDVGMHYHEI-UHFFFAOYSA-N
XLogP2.54
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-dimethylpiperidin-1-yl)-1-(2-ethoxyphenyl)ethanone
CID 43794286
N-acetyl-3-oxo-N-phenylbutanamide
CID 88604895
1-[2-(N-cyclohexylanilino)-2-oxoethyl]-5-methylpiperidine-3-carboxylic acid
CID 122121628
2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-N-(phenylcarbamoyl)acetamide
CID 8540742
4-[2-(3,5-dimethylpiperidin-1-yl)acetyl]-N-phenylpiperazine-1-carboxamide
CID 18093895
N-(2-bromophenyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8930765
2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 8930825
N-(1-benzylpiperidin-4-yl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8542398
5-methyl-1-[2-[methyl(3-phenoxypropyl)amino]-2-oxoethyl]piperidine-3-carboxylic acid
CID 122121400
2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 8930541
N-[2-(aminomethyl)phenyl]-2-(3,5-dimethylpiperidin-1-yl)acetamide
CID 16787564
3-(3,5-dimethylpiperidin-1-yl)-N-phenylpropanamide;hydrochloride
CID 126467812

Frequently Asked Questions

What is the IUPAC name of N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide?
The IUPAC name of N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide (CID 150565764) is N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide.
What is the SMILES notation for N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide?
The canonical SMILES for N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide is CC(=O)N(C(=O)CN1CC(C)CC(C)C1)c1ccccc1.
What is the InChIKey of N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide?
The InChIKey is IKUMSDVGMHYHEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-13-9-14(2)11-18(10-13)12-17(21)19(15(3)20)16-7-5-4-6-8-16/h4-8,13-14H,9-12H2,1-3H3.
What are the key properties of N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide?
N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide has a molecular weight of 288.39 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-2-(3,5-dimethylpiperidin-1-yl)-N-phenylacetamide is sourced from PubChem (CID 150565764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).