N-(cyclopropylmethyl)-N-ethylmethanesulfonamide

C7H15NO2S — CID 64585729

IUPACN-(cyclopropylmethyl)-N-ethylmethanesulfonamide
SMILESCCN(CC1CC1)S(C)(=O)=O
InChIInChI=1S/C7H15NO2S/c1-3-8(11(2,9)10)6-7-4-5-7/h7H,3-6H2,1-2H3
InChIKeyNSXSRDLKRJYPOE-UHFFFAOYSA-N
MW177.27 g/mol
LogP0.68
Rot. Bonds4

About N-(cyclopropylmethyl)-N-ethylmethanesulfonamide

N-(cyclopropylmethyl)-N-ethylmethanesulfonamide (PubChem CID 64585729) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-ethylmethanesulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-ethylmethanesulfonamide
PubChem CID64585729
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC NameN-(cyclopropylmethyl)-N-ethylmethanesulfonamide
SMILESCCN(CC1CC1)S(C)(=O)=O
InChIInChI=1S/C7H15NO2S/c1-3-8(11(2,9)10)6-7-4-5-7/h7H,3-6H2,1-2H3
InChIKeyNSXSRDLKRJYPOE-UHFFFAOYSA-N
XLogP0.68
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-ethylmethanesulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-N-ethylmethanesulfonamide (CID 64585729) is N-(cyclopropylmethyl)-N-ethylmethanesulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-ethylmethanesulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-ethylmethanesulfonamide is CCN(CC1CC1)S(C)(=O)=O.
What is the InChIKey of N-(cyclopropylmethyl)-N-ethylmethanesulfonamide?
The InChIKey is NSXSRDLKRJYPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-3-8(11(2,9)10)6-7-4-5-7/h7H,3-6H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-N-ethylmethanesulfonamide?
N-(cyclopropylmethyl)-N-ethylmethanesulfonamide has a molecular weight of 177.27 g/mol, XLogP of 0.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-ethylmethanesulfonamide is sourced from PubChem (CID 64585729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).