1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide

C13H25N3O2 — CID 16909145

IUPAC1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide
SMILESCC(C)CCNC(=O)C1CCN(CC(N)=O)CC1
InChIInChI=1S/C13H25N3O2/c1-10(2)3-6-15-13(18)11-4-7-16(8-5-11)9-12(14)17/h10-11H,3-9H2,1-2H3,(H2,14,17)(H,15,18)
InChIKeyMSEQJAJFPGIEBN-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.35
Rot. Bonds6

About 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide

1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide (PubChem CID 16909145) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide
PubChem CID16909145
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide
SMILESCC(C)CCNC(=O)C1CCN(CC(N)=O)CC1
InChIInChI=1S/C13H25N3O2/c1-10(2)3-6-15-13(18)11-4-7-16(8-5-11)9-12(14)17/h10-11H,3-9H2,1-2H3,(H2,14,17)(H,15,18)
InChIKeyMSEQJAJFPGIEBN-UHFFFAOYSA-N
XLogP0.35
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide 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

1-[(4-ethylphenyl)methyl]-N-(3-methylbutyl)piperidine-4-carboxamide
CID 795830
4-N-(3-methylbutyl)-1-N-propylcyclohexane-1,4-dicarboxamide
CID 109144333
N-(3-methylbutyl)oxane-4-carboxamide
CID 51110017
2-(4-acetylpiperidin-1-yl)acetamide
CID 59463755
1-(2-amino-2-oxoethyl)-N-[2-(cyclohexen-1-yl)ethyl]piperidine-4-carboxamide
CID 16909150
2-[4-[[[amino-(3-methylbutylamino)methylidene]amino]methyl]piperidin-1-yl]-N-tert-butylacetamide;hydroiodide
CID 111859766
N-(5-methylhexyl)-1-(2-propan-2-yloxyethyl)piperidine-4-carboxamide
CID 169317104
1-[1-(cyclopentanecarbonyl)piperidin-4-yl]-N-(3-methylbutyl)piperidine-4-carboxamide
CID 42881490
1-(2-amino-2-oxoethyl)-N-[(1S)-1-(4-hydroxyphenyl)ethyl]piperidine-4-carboxamide
CID 97134473
N-(3-methylbutyl)-4-(3-methylpiperidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109149725
N-[3-[[amino-(3-methylbutylamino)methylidene]amino]propyl]cyclobutanecarboxamide;hydroiodide
CID 111752297
1-[2-[4-(3-methylbutylcarbamoyl)piperidin-1-yl]-2-oxoethyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 119909521

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide (CID 16909145) is 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide is CC(C)CCNC(=O)C1CCN(CC(N)=O)CC1.
What is the InChIKey of 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide?
The InChIKey is MSEQJAJFPGIEBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-10(2)3-6-15-13(18)11-4-7-16(8-5-11)9-12(14)17/h10-11H,3-9H2,1-2H3,(H2,14,17)(H,15,18).
What are the key properties of 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide?
1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 0.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-oxoethyl)-N-(3-methylbutyl)piperidine-4-carboxamide is sourced from PubChem (CID 16909145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).