N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide

C11H22N2O3S — CID 66004186

IUPACN-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide
SMILESCC1CCCN(S(=O)(=O)NCC2CC(O)C2)C1
InChIInChI=1S/C11H22N2O3S/c1-9-3-2-4-13(8-9)17(15,16)12-7-10-5-11(14)6-10/h9-12,14H,2-8H2,1H3
InChIKeyKUFFBNMXGZIMOF-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.32
Rot. Bonds4

About N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide

N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide (PubChem CID 66004186) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide
PubChem CID66004186
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide
SMILESCC1CCCN(S(=O)(=O)NCC2CC(O)C2)C1
InChIInChI=1S/C11H22N2O3S/c1-9-3-2-4-13(8-9)17(15,16)12-7-10-5-11(14)6-10/h9-12,14H,2-8H2,1H3
InChIKeyKUFFBNMXGZIMOF-UHFFFAOYSA-N
XLogP0.32
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxypropyl)-3,5-dimethylpiperidine-1-sulfonamide
CID 43502311
4-tert-butyl-N-[(3S)-3-hydroxypentyl]piperidine-1-sulfonamide
CID 97151798
4-(1-hydroxyethyl)-N-(2,2,2-trifluoroethyl)piperidine-1-sulfonamide
CID 106837145
N-(3-hydroxypropyl)-3,5-dimethylpiperidine-1-sulfonamide
CID 43501431
N-(3-hydroxypropyl)-3-methylpiperidine-1-sulfonamide
CID 43501573
N-(1-hydroxybutan-2-yl)-3,5-dimethylpiperidine-1-sulfonamide
CID 43501592
N-(1-hydroxybutan-2-yl)-3-methylpiperidine-1-sulfonamide
CID 43501764
N-(2-hydroxyethyl)-3,5-dimethylpiperidine-1-sulfonamide
CID 43501948
N-(2-hydroxyethyl)-3-methylpiperidine-1-sulfonamide
CID 43502085
N-(2-hydroxypropyl)-3-methylpiperidine-1-sulfonamide
CID 43502414
N-(2-hydroxypropyl)-4-methylpiperidine-1-sulfonamide
CID 43502418
N-(3-aminopropyl)-4-(hydroxymethyl)-N-methylpiperidine-1-sulfonamide
CID 54952400

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide?
The IUPAC name of N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide (CID 66004186) is N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide is CC1CCCN(S(=O)(=O)NCC2CC(O)C2)C1.
What is the InChIKey of N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide?
The InChIKey is KUFFBNMXGZIMOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-9-3-2-4-13(8-9)17(15,16)12-7-10-5-11(14)6-10/h9-12,14H,2-8H2,1H3.
What are the key properties of N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide?
N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide has a molecular weight of 262.37 g/mol, XLogP of 0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxycyclobutyl)methyl]-3-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 66004186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).