1-(2-methoxypropanoyl)piperidine-3-sulfonamide

C9H18N2O4S — CID 115643260

IUPAC1-(2-methoxypropanoyl)piperidine-3-sulfonamide
SMILESCOC(C)C(=O)N1CCCC(S(N)(=O)=O)C1
InChIInChI=1S/C9H18N2O4S/c1-7(15-2)9(12)11-5-3-4-8(6-11)16(10,13)14/h7-8H,3-6H2,1-2H3,(H2,10,13,14)
InChIKeyRJKPTNLYHJXVPZ-UHFFFAOYSA-N
MW250.32 g/mol
LogP-0.70
Rot. Bonds3

About 1-(2-methoxypropanoyl)piperidine-3-sulfonamide

1-(2-methoxypropanoyl)piperidine-3-sulfonamide (PubChem CID 115643260) has the molecular formula C9H18N2O4S and a molecular weight of 250.32 g/mol. Its IUPAC name is 1-(2-methoxypropanoyl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name1-(2-methoxypropanoyl)piperidine-3-sulfonamide
PubChem CID115643260
Molecular FormulaC9H18N2O4S
Molecular Weight250.32 g/mol
Exact Mass250.10
IUPAC Name1-(2-methoxypropanoyl)piperidine-3-sulfonamide
SMILESCOC(C)C(=O)N1CCCC(S(N)(=O)=O)C1
InChIInChI=1S/C9H18N2O4S/c1-7(15-2)9(12)11-5-3-4-8(6-11)16(10,13)14/h7-8H,3-6H2,1-2H3,(H2,10,13,14)
InChIKeyRJKPTNLYHJXVPZ-UHFFFAOYSA-N
XLogP-0.70
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxy-2-phenylacetyl)piperidine-3-sulfonamide
CID 62098751
1-(3-fluoropiperidin-1-yl)-2-methoxypropan-1-one
CID 164659441
1-(2-methoxy-2-methylpropanoyl)piperidine-3-sulfonamide
CID 103710680
N,N-diethyl-3-sulfamoylpiperidine-1-carboxamide
CID 79162189
tert-butyl 3-sulfamoylpiperidine-1-carboxylate
CID 122702227
(3R)-1-[(2S)-2-thiophen-2-ylpropanoyl]piperidine-3-sulfonamide
CID 97218661
(3S)-1-[2-(dimethylamino)acetyl]piperidine-3-sulfonamide
CID 129414224
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-methoxypropan-1-one
CID 115597897
1-[2-(1-methoxycyclobutyl)acetyl]piperidine-3-sulfonamide
CID 103522077
2-methoxy-1-(3-propoxypiperidin-1-yl)propan-1-one
CID 112687423
N-(2-aminoethyl)-1-(2-methoxypropanoyl)piperidine-3-carboxamide;hydrochloride
CID 119482363
(3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide
CID 97348594

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxypropanoyl)piperidine-3-sulfonamide?
The IUPAC name of 1-(2-methoxypropanoyl)piperidine-3-sulfonamide (CID 115643260) is 1-(2-methoxypropanoyl)piperidine-3-sulfonamide.
What is the SMILES notation for 1-(2-methoxypropanoyl)piperidine-3-sulfonamide?
The canonical SMILES for 1-(2-methoxypropanoyl)piperidine-3-sulfonamide is COC(C)C(=O)N1CCCC(S(N)(=O)=O)C1.
What is the InChIKey of 1-(2-methoxypropanoyl)piperidine-3-sulfonamide?
The InChIKey is RJKPTNLYHJXVPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O4S/c1-7(15-2)9(12)11-5-3-4-8(6-11)16(10,13)14/h7-8H,3-6H2,1-2H3,(H2,10,13,14).
What are the key properties of 1-(2-methoxypropanoyl)piperidine-3-sulfonamide?
1-(2-methoxypropanoyl)piperidine-3-sulfonamide has a molecular weight of 250.32 g/mol, XLogP of -0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxypropanoyl)piperidine-3-sulfonamide is sourced from PubChem (CID 115643260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).