N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide

C8H17NO2S — CID 126683103

IUPACN-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)NCC1CC1
InChIInChI=1S/C8H17NO2S/c1-8(2,3)12(10,11)9-6-7-4-5-7/h7,9H,4-6H2,1-3H3
InChIKeyIEEOJOCSFSHTCB-UHFFFAOYSA-N
MW191.30 g/mol
LogP1.11
Rot. Bonds3

About N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide

N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide (PubChem CID 126683103) has the molecular formula C8H17NO2S and a molecular weight of 191.30 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide
PubChem CID126683103
Molecular FormulaC8H17NO2S
Molecular Weight191.30 g/mol
Exact Mass191.10
IUPAC NameN-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)NCC1CC1
InChIInChI=1S/C8H17NO2S/c1-8(2,3)12(10,11)9-6-7-4-5-7/h7,9H,4-6H2,1-3H3
InChIKeyIEEOJOCSFSHTCB-UHFFFAOYSA-N
XLogP1.11
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.30
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide (CID 126683103) is N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide is CC(C)(C)S(=O)(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide?
The InChIKey is IEEOJOCSFSHTCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2S/c1-8(2,3)12(10,11)9-6-7-4-5-7/h7,9H,4-6H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide?
N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide has a molecular weight of 191.30 g/mol, XLogP of 1.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-methylpropane-2-sulfonamide is sourced from PubChem (CID 126683103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).