N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide

C15H28N2O2 — CID 108521523

IUPACN-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide
SMILESCCCCN(CCC)C(=O)C(=O)N1CCCCC1C
InChIInChI=1S/C15H28N2O2/c1-4-6-11-16(10-5-2)14(18)15(19)17-12-8-7-9-13(17)3/h13H,4-12H2,1-3H3
InChIKeyULGJOVQGIGXUSX-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.43
Rot. Bonds5

About N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide

N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide (PubChem CID 108521523) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide.

Molecular Properties

Compound NameN-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide
PubChem CID108521523
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide
SMILESCCCCN(CCC)C(=O)C(=O)N1CCCCC1C
InChIInChI=1S/C15H28N2O2/c1-4-6-11-16(10-5-2)14(18)15(19)17-12-8-7-9-13(17)3/h13H,4-12H2,1-3H3
InChIKeyULGJOVQGIGXUSX-UHFFFAOYSA-N
XLogP2.43
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide 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-(dipropylamino)-1-(2-methylpiperidin-1-yl)ethanone
CID 86910557
N-butyl-N-propylcyclopentanecarboxamide
CID 91693798
1-(2-methylpiperidin-1-yl)dodecan-1-one
CID 3275984
N-benzyl-N-(2-hydroxyethyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
CID 108523337
1-(dibutylcarbamoyl)-2-methylpiperidine-4-carboxylic acid
CID 106743882
1-butyl-3-cyclopentyl-1-propylurea
CID 108902721
1,5-bis[(2R)-2-methylpiperidin-1-yl]pentane-1,5-dione
CID 40599340
ethane;1-(2-methylpiperidin-1-yl)ethanone;propane
CID 169253047
1-[(2S)-2-methylazepan-1-yl]-6-[(2R)-2-methylazepan-1-yl]hexane-1,6-dione
CID 97317052
2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide
CID 108521516
N-butan-2-yl-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
CID 108505442
2-[1-[butyl(2-hydroxyethyl)carbamoyl]piperidin-2-yl]acetic acid
CID 61447659

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide?
The IUPAC name of N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide (CID 108521523) is N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide.
What is the SMILES notation for N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide?
The canonical SMILES for N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide is CCCCN(CCC)C(=O)C(=O)N1CCCCC1C.
What is the InChIKey of N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide?
The InChIKey is ULGJOVQGIGXUSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-4-6-11-16(10-5-2)14(18)15(19)17-12-8-7-9-13(17)3/h13H,4-12H2,1-3H3.
What are the key properties of N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide?
N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide has a molecular weight of 268.40 g/mol, XLogP of 2.43, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-(2-methylpiperidin-1-yl)-2-oxo-N-propylacetamide is sourced from PubChem (CID 108521523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).