N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide

C16H28N2O3 — CID 10935341

IUPACN-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide
SMILESCCCCCCCCCCC(=O)N[C@H]1CCC(=O)NC1=O
InChIInChI=1S/C16H28N2O3/c1-2-3-4-5-6-7-8-9-10-14(19)17-13-11-12-15(20)18-16(13)21/h13H,2-12H2,1H3,(H,17,19)(H,18,20,21)/t13-/m0/s1
InChIKeyCDGCHMSOVNBJOE-ZDUSSCGKSA-N
MW296.41 g/mol
LogP2.44
Rot. Bonds10

About N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide

N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide (PubChem CID 10935341) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide.

Molecular Properties

Compound NameN-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide
PubChem CID10935341
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC NameN-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide
SMILESCCCCCCCCCCC(=O)N[C@H]1CCC(=O)NC1=O
InChIInChI=1S/C16H28N2O3/c1-2-3-4-5-6-7-8-9-10-14(19)17-13-11-12-15(20)18-16(13)21/h13H,2-12H2,1H3,(H,17,19)(H,18,20,21)/t13-/m0/s1
InChIKeyCDGCHMSOVNBJOE-ZDUSSCGKSA-N
XLogP2.44
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(S)-N-(2,6-Dioxopiperidin-3-yl)undec-10-enamide
CID 9796154
N-Lauroyl-L-glutamic acid di-n-butylamide
CID 113401
4-Dodecanoylpiperazine-2,6-dione
CID 2775706
N-[(3S)-1-methyl-2,6-dioxopiperidin-3-yl]undec-10-enamide
CID 10935747
(S)-N-(2,6-Dioxopiperidin-3-yl)pentanamide
CID 10965828
N-[(3S)-2,6-dioxopiperidin-3-yl]heptanamide
CID 10966632
N-[(3S)-2,6-dioxopiperidin-3-yl]nonanamide
CID 11054677
N-[(3S)-2,6-dioxopiperidin-3-yl]-2-propylpentanamide
CID 11107895
N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide
CID 11380857
Tocris-1628
CID 6604894
N-[(1S)-5-Amino-1-[[(4-amino-1-oxobutyl)(2-amino-2-oxoethyl)amino]methyl]pentyl]hexadecanamide
CID 57413875
2-Pyrrolidinecarboxamide, N-(4-(2,6-dimethyl-1-piperidinyl)-2-butynyl)-5-oxo-, (S)-
CID 338466

Frequently Asked Questions

What is the IUPAC name of N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide?
The IUPAC name of N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide (CID 10935341) is N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide.
What is the SMILES notation for N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide?
The canonical SMILES for N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide is CCCCCCCCCCC(=O)N[C@H]1CCC(=O)NC1=O.
What is the InChIKey of N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide?
The InChIKey is CDGCHMSOVNBJOE-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-2-3-4-5-6-7-8-9-10-14(19)17-13-11-12-15(20)18-16(13)21/h13H,2-12H2,1H3,(H,17,19)(H,18,20,21)/t13-/m0/s1.
What are the key properties of N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide?
N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide has a molecular weight of 296.41 g/mol, XLogP of 2.44, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide is sourced from PubChem (CID 10935341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).