N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide

C12H18N2O3 — CID 142390044

IUPACN-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide
SMILESC=C(CCC)C(=O)N(C)C1CCC(=O)NC1=O
InChIInChI=1S/C12H18N2O3/c1-4-5-8(2)12(17)14(3)9-6-7-10(15)13-11(9)16/h9H,2,4-7H2,1,3H3,(H,13,15,16)
InChIKeyGUGZSRAQZXGDFK-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.61
Rot. Bonds4

About N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide

N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide (PubChem CID 142390044) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide.

Molecular Properties

Compound NameN-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide
PubChem CID142390044
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC NameN-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide
SMILESC=C(CCC)C(=O)N(C)C1CCC(=O)NC1=O
InChIInChI=1S/C12H18N2O3/c1-4-5-8(2)12(17)14(3)9-6-7-10(15)13-11(9)16/h9H,2,4-7H2,1,3H3,(H,13,15,16)
InChIKeyGUGZSRAQZXGDFK-UHFFFAOYSA-N
XLogP0.61
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

Dimethacryloyl piperazine
CID 22476841
3-[[(2Z)-2-(fluoromethylidene)butyl]amino]piperidine-2,6-dione
CID 147501193
3-[(4Z)-4-(fluoromethylidene)-3-methylidene-2-oxopyrrolidin-1-yl]piperidine-2,6-dione
CID 153392074
[(2,6-Dioxopiperidin-3-yl)-(2-methylprop-2-enoyl)amino]methyl hypofluorite
CID 154957631
N-(2,6-dioxopiperidin-3-yl)-3-fluoro-3-methyl-2-methylidenebutanamide
CID 155036890
3-[(3-Fluoro-2-methylidenebutyl)amino]piperidine-2,6-dione
CID 167275823
N-(2,6-dioxopiperidin-3-yl)-6-fluoro-2-methylideneheptanamide
CID 169574444
N-(2,6-dioxopiperidin-3-yl)-3-fluoro-3,4-dimethyl-2-methylidenepentanamide
CID 170409681
(4R)-N-(2,6-dioxopiperidin-3-yl)-3-fluoro-4,5-dimethyl-2-methylidenehexanamide
CID 173767075
(4S)-N-(2,6-dioxopiperidin-3-yl)-4-fluoro-3,3-dimethyl-2-methylidenepentanamide
CID 173877682
(4S,5S)-N-(2,6-dioxopiperidin-3-yl)-5-fluoro-3,4-dimethyl-2-methylidenehexanamide
CID 173929684
(2S)-2-(2-methylprop-2-enoylamino)pentanediamide
CID 54561503

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide?
The IUPAC name of N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide (CID 142390044) is N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide.
What is the SMILES notation for N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide?
The canonical SMILES for N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide is C=C(CCC)C(=O)N(C)C1CCC(=O)NC1=O.
What is the InChIKey of N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide?
The InChIKey is GUGZSRAQZXGDFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-4-5-8(2)12(17)14(3)9-6-7-10(15)13-11(9)16/h9H,2,4-7H2,1,3H3,(H,13,15,16).
What are the key properties of N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide?
N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide has a molecular weight of 238.29 g/mol, XLogP of 0.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-methylidenepentanamide is sourced from PubChem (CID 142390044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).