N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide

C10H18N2O2S — CID 63689534

IUPACN-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)NC1(C#N)CCCC1
InChIInChI=1S/C10H18N2O2S/c1-9(2,3)15(13,14)12-10(8-11)6-4-5-7-10/h12H,4-7H2,1-3H3
InChIKeyMKYWDYHDJIMOTN-UHFFFAOYSA-N
MW230.33 g/mol
LogP1.54
Rot. Bonds2

About N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide

N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide (PubChem CID 63689534) has the molecular formula C10H18N2O2S and a molecular weight of 230.33 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide
PubChem CID63689534
Molecular FormulaC10H18N2O2S
Molecular Weight230.33 g/mol
Exact Mass230.11
IUPAC NameN-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)NC1(C#N)CCCC1
InChIInChI=1S/C10H18N2O2S/c1-9(2,3)15(13,14)12-10(8-11)6-4-5-7-10/h12H,4-7H2,1-3H3
InChIKeyMKYWDYHDJIMOTN-UHFFFAOYSA-N
XLogP1.54
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.33
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide (CID 63689534) is N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide is CC(C)(C)S(=O)(=O)NC1(C#N)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide?
The InChIKey is MKYWDYHDJIMOTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S/c1-9(2,3)15(13,14)12-10(8-11)6-4-5-7-10/h12H,4-7H2,1-3H3.
What are the key properties of N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide?
N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide has a molecular weight of 230.33 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-2-methylpropane-2-sulfonamide is sourced from PubChem (CID 63689534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).