N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide

C15H18N2O3 — CID 168945690

IUPACN-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide
SMILESCCCc1ccc(C(=O)NC2CCC(=O)NC2=O)cc1
InChIInChI=1S/C15H18N2O3/c1-2-3-10-4-6-11(7-5-10)14(19)16-12-8-9-13(18)17-15(12)20/h4-7,12H,2-3,8-9H2,1H3,(H,16,19)(H,17,18,20)
InChIKeyLKYGDKHNEDHRBM-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.17
Rot. Bonds4

About N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide

N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide (PubChem CID 168945690) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide.

Molecular Properties

Compound NameN-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide
PubChem CID168945690
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide
SMILESCCCc1ccc(C(=O)NC2CCC(=O)NC2=O)cc1
InChIInChI=1S/C15H18N2O3/c1-2-3-10-4-6-11(7-5-10)14(19)16-12-8-9-13(18)17-15(12)20/h4-7,12H,2-3,8-9H2,1H3,(H,16,19)(H,17,18,20)
InChIKeyLKYGDKHNEDHRBM-UHFFFAOYSA-N
XLogP1.17
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,6-dioxopiperidin-3-yl)-4-ethylsulfonylbenzamide
CID 146124036
4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide
CID 2363882
N-(2,6-dioxopiperidin-3-yl)benzamide;ethane
CID 156866709
N-(2,6-dioxopiperidin-3-yl)-4-nitrobenzamide
CID 10378768
N-(2,6-dioxopiperidin-3-yl)-3-(4-hydroxyphenyl)propanamide
CID 110483854
4-butyl-N-[(3R)-2-oxopiperidin-3-yl]benzamide
CID 54765874
methyl 3-[(2,6-dioxopiperidin-3-yl)carbamoyl]benzoate
CID 146129215
N-(2,6-dioxopiperidin-3-yl)-4-fluoro-3-methoxybenzamide
CID 81285163
2-(4-chlorophenyl)-N-[(3S)-2,6-dioxopiperidin-3-yl]acetamide
CID 110186635
N-[(3S)-2,6-dioxopiperidin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 95988791
N-(2,6-dioxopiperidin-3-yl)-1,3-benzoxazole-5-carboxamide
CID 154810751
N-(2,6-dioxopiperidin-3-yl)-3-phenylbenzamide
CID 138467355

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide?
The IUPAC name of N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide (CID 168945690) is N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide.
What is the SMILES notation for N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide?
The canonical SMILES for N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide is CCCc1ccc(C(=O)NC2CCC(=O)NC2=O)cc1.
What is the InChIKey of N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide?
The InChIKey is LKYGDKHNEDHRBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-2-3-10-4-6-11(7-5-10)14(19)16-12-8-9-13(18)17-15(12)20/h4-7,12H,2-3,8-9H2,1H3,(H,16,19)(H,17,18,20).
What are the key properties of N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide?
N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide has a molecular weight of 274.32 g/mol, XLogP of 1.17, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide is sourced from PubChem (CID 168945690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).