4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide

C13H23N3O2 — CID 114269609

IUPAC4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide
SMILESCC1CC(C)NC(C(=O)NC2CCCNC2=O)C1
InChIInChI=1S/C13H23N3O2/c1-8-6-9(2)15-11(7-8)13(18)16-10-4-3-5-14-12(10)17/h8-11,15H,3-7H2,1-2H3,(H,14,17)(H,16,18)
InChIKeyHVCXMZWUVVDRFE-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.16
Rot. Bonds2

About 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide

4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide (PubChem CID 114269609) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide
PubChem CID114269609
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide
SMILESCC1CC(C)NC(C(=O)NC2CCCNC2=O)C1
InChIInChI=1S/C13H23N3O2/c1-8-6-9(2)15-11(7-8)13(18)16-10-4-3-5-14-12(10)17/h8-11,15H,3-7H2,1-2H3,(H,14,17)(H,16,18)
InChIKeyHVCXMZWUVVDRFE-UHFFFAOYSA-N
XLogP0.16
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-oxoazepan-3-yl)pyrrolidine-2-carboxamide
CID 43704078
3-[(2-oxopiperidin-3-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103550647
4-amino-2-methyl-N-(2-oxopiperidin-3-yl)cyclohexane-1-carboxamide
CID 62783041
2-amino-2-methyl-N-(2-oxopiperidin-3-yl)propanamide
CID 62092380
3-[(3,5-dimethylcyclohexyl)amino]piperidin-2-one
CID 64751431
1-cyclohexyl-3-(2-oxopiperidin-3-yl)urea
CID 110472697
(2S)-2-hydroxy-N-(2-oxopiperidin-3-yl)propanamide
CID 130978731
3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide
CID 65266745
N-(2-oxopiperidin-3-yl)butanamide
CID 62054699
N-(2-oxoazepan-3-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76887963
(2-oxoazepan-3-yl)carbamic acid
CID 18612606
N-(2-oxopiperidin-3-yl)prop-2-enamide
CID 62092726

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide?
The IUPAC name of 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide (CID 114269609) is 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide.
What is the SMILES notation for 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide?
The canonical SMILES for 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide is CC1CC(C)NC(C(=O)NC2CCCNC2=O)C1.
What is the InChIKey of 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide?
The InChIKey is HVCXMZWUVVDRFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-8-6-9(2)15-11(7-8)13(18)16-10-4-3-5-14-12(10)17/h8-11,15H,3-7H2,1-2H3,(H,14,17)(H,16,18).
What are the key properties of 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide?
4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide has a molecular weight of 253.35 g/mol, XLogP of 0.16, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-N-(2-oxopiperidin-3-yl)piperidine-2-carboxamide is sourced from PubChem (CID 114269609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).