4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide

C14H23N3O3 — CID 114429205

IUPAC4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NC2CCC(=O)N(C)C2=O)C1
InChIInChI=1S/C14H23N3O3/c1-3-9-6-7-15-11(8-9)13(19)16-10-4-5-12(18)17(2)14(10)20/h9-11,15H,3-8H2,1-2H3,(H,16,19)
InChIKeyYDDMFRVWXSANHQ-UHFFFAOYSA-N
MW281.36 g/mol
LogP0.03
Rot. Bonds3

About 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide

4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide (PubChem CID 114429205) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide
PubChem CID114429205
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NC2CCC(=O)N(C)C2=O)C1
InChIInChI=1S/C14H23N3O3/c1-3-9-6-7-15-11(8-9)13(19)16-10-4-5-12(18)17(2)14(10)20/h9-11,15H,3-8H2,1-2H3,(H,16,19)
InChIKeyYDDMFRVWXSANHQ-UHFFFAOYSA-N
XLogP0.03
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-ethyl-N-(1-methyl-6-oxopiperidin-3-yl)piperidine-2-carboxamide
CID 114429128
N-(1-methyl-2,6-dioxopiperidin-3-yl)thiomorpholine-3-carboxamide
CID 82915610
N-(1-methyl-2,6-dioxopiperidin-3-yl)-5-oxopiperazine-2-carboxamide
CID 107436893
N-(3,5-dimethylcyclohexyl)-4-ethylpiperidine-2-carboxamide
CID 114429133
4-ethyl-N-(oxolan-3-yl)piperidine-2-carboxamide
CID 114429328
4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
CID 114428071
N-cyclopropylsulfonyl-4-ethylpiperidine-2-carboxamide
CID 103308466
4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide
CID 114629713
4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide
CID 114428843
4-ethyl-N-(3-methylbutan-2-yl)piperidine-2-carboxamide
CID 114428012
trans-(1R,2R)-2-(4-fluorophenyl)-N-(1-methyl-2,6-dioxopiperidin-3-yl)cyclopropane-1-carboxamide
CID 146150011
N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide
CID 114429439

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide (CID 114429205) is 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide is CCC1CCNC(C(=O)NC2CCC(=O)N(C)C2=O)C1.
What is the InChIKey of 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide?
The InChIKey is YDDMFRVWXSANHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-3-9-6-7-15-11(8-9)13(19)16-10-4-5-12(18)17(2)14(10)20/h9-11,15H,3-8H2,1-2H3,(H,16,19).
What are the key properties of 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide?
4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(1-methyl-2,6-dioxopiperidin-3-yl)piperidine-2-carboxamide is sourced from PubChem (CID 114429205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).