N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide

C11H18N2O2S — CID 59341012

IUPACN-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide
SMILESCC(C)CN(Cc1ccccn1)S(C)(=O)=O
InChIInChI=1S/C11H18N2O2S/c1-10(2)8-13(16(3,14)15)9-11-6-4-5-7-12-11/h4-7,10H,8-9H2,1-3H3
InChIKeySQUNMLUFYNXTDL-UHFFFAOYSA-N
MW242.34 g/mol
LogP1.50
Rot. Bonds5

About N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide

N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide (PubChem CID 59341012) has the molecular formula C11H18N2O2S and a molecular weight of 242.34 g/mol. Its IUPAC name is N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide
PubChem CID59341012
Molecular FormulaC11H18N2O2S
Molecular Weight242.34 g/mol
Exact Mass242.11
IUPAC NameN-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide
SMILESCC(C)CN(Cc1ccccn1)S(C)(=O)=O
InChIInChI=1S/C11H18N2O2S/c1-10(2)8-13(16(3,14)15)9-11-6-4-5-7-12-11/h4-7,10H,8-9H2,1-3H3
InChIKeySQUNMLUFYNXTDL-UHFFFAOYSA-N
XLogP1.50
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(hydroxymethyl)phenyl]methyl]-N-(pyridin-2-ylmethyl)methanesulfonamide
CID 110005953
N-methyl-3-methylsulfonyl-N-(pyridin-2-ylmethyl)butan-2-amine
CID 56790019
2-[methylsulfonyl(pyridin-2-ylmethyl)amino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 113151528
N-benzyl-2-[methylsulfonyl(pyridin-2-ylmethyl)amino]acetamide
CID 113151439
N-[(2-chloro-1,3-thiazol-4-yl)methyl]-N-(pyridin-2-ylmethyl)methanesulfonamide
CID 122155298
N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-N-(pyridin-2-ylmethyl)methanesulfonamide
CID 113151434
N-(4-chlorophenyl)-2-[methylsulfonyl(pyridin-2-ylmethyl)amino]acetamide
CID 113151514
N-(3,5-dimethylphenyl)-2-[methylsulfonyl(pyridin-2-ylmethyl)amino]acetamide
CID 113151497
2-[methylsulfonyl(pyridin-2-ylmethyl)amino]-N-pentylacetamide
CID 113151480
N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide
CID 61355533
N-tert-butyl-3-[methylsulfonyl(pyridin-2-ylmethyl)amino]propanamide
CID 113139783
N-ethyl-2-phenyl-N-(pyridin-2-ylmethyl)propane-1-sulfonamide
CID 71914419

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide?
The IUPAC name of N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide (CID 59341012) is N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide?
The canonical SMILES for N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide is CC(C)CN(Cc1ccccn1)S(C)(=O)=O.
What is the InChIKey of N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide?
The InChIKey is SQUNMLUFYNXTDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S/c1-10(2)8-13(16(3,14)15)9-11-6-4-5-7-12-11/h4-7,10H,8-9H2,1-3H3.
What are the key properties of N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide?
N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide has a molecular weight of 242.34 g/mol, XLogP of 1.50, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide is sourced from PubChem (CID 59341012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).