N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide

C16H26N2O3 — CID 11380857

IUPACN-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide
SMILESC=CCCCCCCCCC(=O)N[C@@H]1CCC(=O)NC1=O
InChIInChI=1S/C16H26N2O3/c1-2-3-4-5-6-7-8-9-10-14(19)17-13-11-12-15(20)18-16(13)21/h2,13H,1,3-12H2,(H,17,19)(H,18,20,21)/t13-/m1/s1
InChIKeyQGYRJLOWWHNQAD-CYBMUJFWSA-N
MW294.39 g/mol
LogP2.21
Rot. Bonds10

About N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide

N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide (PubChem CID 11380857) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide.

Molecular Properties

Compound NameN-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide
PubChem CID11380857
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC NameN-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide
SMILESC=CCCCCCCCCC(=O)N[C@@H]1CCC(=O)NC1=O
InChIInChI=1S/C16H26N2O3/c1-2-3-4-5-6-7-8-9-10-14(19)17-13-11-12-15(20)18-16(13)21/h2,13H,1,3-12H2,(H,17,19)(H,18,20,21)/t13-/m1/s1
InChIKeyQGYRJLOWWHNQAD-CYBMUJFWSA-N
XLogP2.21
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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-[(3S)-2-oxopiperidin-3-yl]undec-10-enamide
CID 11076846
N-[(3S)-2,6-dioxopiperidin-3-yl]undecanamide
CID 10935341
N-[(3S)-1-methyl-2,6-dioxopiperidin-3-yl]undec-10-enamide
CID 10935747
N-[(3S)-2-oxoazepan-3-yl]undec-10-enamide
CID 11197173
N-[(3S)-2,6-dioxopiperidin-3-yl]-10,11-ditritioundecanamide
CID 49799815
N-(2,6-dioxopiperidin-4-yl)undec-10-enamide
CID 66893961
(2S)-2-(undec-10-enoylamino)pentanediamide
CID 10979857
3-(Undec-10-enoylamino)-dihydropyridine-2,6(1h,2h)-dione
CID 10402204
N-[(3S)-2,6-dioxopiperidin-3-yl]undec-2-enamide
CID 57273484
N-(2,6-dioxopiperidin-3-yl)pent-4-enamide
CID 65954285
3-(Pent-4-enylamino)piperidine-2,6-dione
CID 65969313

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide?
The IUPAC name of N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide (CID 11380857) is N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide.
What is the SMILES notation for N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide?
The canonical SMILES for N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide is C=CCCCCCCCCC(=O)N[C@@H]1CCC(=O)NC1=O.
What is the InChIKey of N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide?
The InChIKey is QGYRJLOWWHNQAD-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-2-3-4-5-6-7-8-9-10-14(19)17-13-11-12-15(20)18-16(13)21/h2,13H,1,3-12H2,(H,17,19)(H,18,20,21)/t13-/m1/s1.
What are the key properties of N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide?
N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide has a molecular weight of 294.39 g/mol, XLogP of 2.21, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-2,6-dioxopiperidin-3-yl]undec-10-enamide is sourced from PubChem (CID 11380857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).