N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide

C12H24N2O3S — CID 65113201

IUPACN-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)NCC1(O)CCCC1
InChIInChI=1S/C12H24N2O3S/c1-11-6-2-5-9-14(11)18(16,17)13-10-12(15)7-3-4-8-12/h11,13,15H,2-10H2,1H3
InChIKeySTHSCJQXCIULCE-UHFFFAOYSA-N
MW276.40 g/mol
LogP1.00
Rot. Bonds4

About N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide

N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide (PubChem CID 65113201) has the molecular formula C12H24N2O3S and a molecular weight of 276.40 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide
PubChem CID65113201
Molecular FormulaC12H24N2O3S
Molecular Weight276.40 g/mol
Exact Mass276.15
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)NCC1(O)CCCC1
InChIInChI=1S/C12H24N2O3S/c1-11-6-2-5-9-14(11)18(16,17)13-10-12(15)7-3-4-8-12/h11,13,15H,2-10H2,1H3
InChIKeySTHSCJQXCIULCE-UHFFFAOYSA-N
XLogP1.00
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide (CID 65113201) is N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide is CC1CCCCN1S(=O)(=O)NCC1(O)CCCC1.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide?
The InChIKey is STHSCJQXCIULCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3S/c1-11-6-2-5-9-14(11)18(16,17)13-10-12(15)7-3-4-8-12/h11,13,15H,2-10H2,1H3.
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide?
N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide has a molecular weight of 276.40 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-2-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 65113201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).