N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide

C12H26N2O2S — CID 56795195

IUPACN-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide
SMILESCN(C)CCN(CC1CCCCC1)S(C)(=O)=O
InChIInChI=1S/C12H26N2O2S/c1-13(2)9-10-14(17(3,15)16)11-12-7-5-4-6-8-12/h12H,4-11H2,1-3H3
InChIKeyFNQIGTNWFHDAIT-UHFFFAOYSA-N
MW262.42 g/mol
LogP1.39
Rot. Bonds6

About N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide

N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide (PubChem CID 56795195) has the molecular formula C12H26N2O2S and a molecular weight of 262.42 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide
PubChem CID56795195
Molecular FormulaC12H26N2O2S
Molecular Weight262.42 g/mol
Exact Mass262.17
IUPAC NameN-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide
SMILESCN(C)CCN(CC1CCCCC1)S(C)(=O)=O
InChIInChI=1S/C12H26N2O2S/c1-13(2)9-10-14(17(3,15)16)11-12-7-5-4-6-8-12/h12H,4-11H2,1-3H3
InChIKeyFNQIGTNWFHDAIT-UHFFFAOYSA-N
XLogP1.39
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.42
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide?
The IUPAC name of N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide (CID 56795195) is N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide.
What is the SMILES notation for N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide?
The canonical SMILES for N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide is CN(C)CCN(CC1CCCCC1)S(C)(=O)=O.
What is the InChIKey of N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide?
The InChIKey is FNQIGTNWFHDAIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2S/c1-13(2)9-10-14(17(3,15)16)11-12-7-5-4-6-8-12/h12H,4-11H2,1-3H3.
What are the key properties of N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide?
N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide has a molecular weight of 262.42 g/mol, XLogP of 1.39, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-N-[2-(dimethylamino)ethyl]methanesulfonamide is sourced from PubChem (CID 56795195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).