2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide

C9H18N2O3S — CID 167069682

IUPAC2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)NC1CCNC(=O)C1
InChIInChI=1S/C9H18N2O3S/c1-9(2,3)15(13,14)11-7-4-5-10-8(12)6-7/h7,11H,4-6H2,1-3H3,(H,10,12)
InChIKeyPIPZJZBXNHAODE-UHFFFAOYSA-N
MW234.32 g/mol
LogP-0.02
Rot. Bonds2

About 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide

2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide (PubChem CID 167069682) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide
PubChem CID167069682
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC Name2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)NC1CCNC(=O)C1
InChIInChI=1S/C9H18N2O3S/c1-9(2,3)15(13,14)11-7-4-5-10-8(12)6-7/h7,11H,4-6H2,1-3H3,(H,10,12)
InChIKeyPIPZJZBXNHAODE-UHFFFAOYSA-N
XLogP-0.02
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-4-methyl-N-[(4S)-2-oxopiperidin-4-yl]benzenesulfonamide
CID 125468124
2-methyl-N-(2-oxopiperidin-4-yl)propanamide
CID 112534578
N-(1-azaspiro[5.5]undecan-4-yl)-2-methylpropane-2-sulfonamide
CID 63688997
4-(2,2-dimethylpropyl)piperidin-2-one
CID 76727513
N-[(4S)-2-oxoazepan-4-yl]-4-pentylcyclohexane-1-sulfonamide
CID 140556941
[(4R)-2-oxopiperidin-4-yl]azanium
CID 27282256
4-(2-oxopiperidin-4-yl)piperidin-2-one
CID 66803450
N-(5-oxopyrrolidin-3-yl)ethanesulfonamide
CID 105056076
4-(piperidin-4-ylamino)pyrrolidin-2-one
CID 106184253
2-methyl-N-(4-methylpyrrolidin-3-yl)propane-2-sulfonamide
CID 104826091
4-cyclopropylpiperidin-2-one
CID 75132317
4-methylpiperidin-2-one;propane
CID 142565813

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide?
The IUPAC name of 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide (CID 167069682) is 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide.
What is the SMILES notation for 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide?
The canonical SMILES for 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide is CC(C)(C)S(=O)(=O)NC1CCNC(=O)C1.
What is the InChIKey of 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide?
The InChIKey is PIPZJZBXNHAODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S/c1-9(2,3)15(13,14)11-7-4-5-10-8(12)6-7/h7,11H,4-6H2,1-3H3,(H,10,12).
What are the key properties of 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide?
2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide has a molecular weight of 234.32 g/mol, XLogP of -0.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-oxopiperidin-4-yl)propane-2-sulfonamide is sourced from PubChem (CID 167069682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).