N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide

C7H13N3O2S — CID 119106360

IUPACN-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide
SMILESCN(Cc1ccnn1C)S(C)(=O)=O
InChIInChI=1S/C7H13N3O2S/c1-9(13(3,11)12)6-7-4-5-8-10(7)2/h4-5H,6H2,1-3H3
InChIKeyALXPQUGNAWNEKP-UHFFFAOYSA-N
MW203.27 g/mol
LogP-0.19
Rot. Bonds3

About N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide

N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide (PubChem CID 119106360) has the molecular formula C7H13N3O2S and a molecular weight of 203.27 g/mol. Its IUPAC name is N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide
PubChem CID119106360
Molecular FormulaC7H13N3O2S
Molecular Weight203.27 g/mol
Exact Mass203.07
IUPAC NameN-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide
SMILESCN(Cc1ccnn1C)S(C)(=O)=O
InChIInChI=1S/C7H13N3O2S/c1-9(13(3,11)12)6-7-4-5-8-10(7)2/h4-5H,6H2,1-3H3
InChIKeyALXPQUGNAWNEKP-UHFFFAOYSA-N
XLogP-0.19
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.27
LogP ≤ 5-0.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,3,5-trimethyl-N-[(2-methylpyrazol-3-yl)methyl]-1,2-oxazole-4-sulfonamide
CID 35527395
3,4-dimethoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzenesulfonamide
CID 35521053
N-methyl-N-[(2-methylpyrazol-3-yl)methyl]-5-(trifluoromethyl)pyridine-2-sulfonamide
CID 167942029
N-methyl-N-[(1-methylpyrrol-2-yl)methyl]methanesulfonamide
CID 10679621
4-[methyl-[(2-methylpyrazol-3-yl)methyl]amino]butan-2-ol
CID 115883105
2-chloro-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]acetamide
CID 19619342
2-(2-methylpyrazol-3-yl)ethyl methanesulfonate
CID 118545210
2-methyl-3-[methyl-[(2-methylpyrazol-3-yl)methyl]amino]propanoic acid
CID 65067288
N-methyl-N-[(2-methylpyrazol-3-yl)methyl]but-3-yn-2-amine
CID 130635384
5-(bromomethyl)-1-methylpyrazole
CID 59589503
5-(iodomethyl)-1-methylpyrazole
CID 126698907
1-(2-methylpyrazol-3-yl)-4-methylsulfonylpentan-3-one
CID 103024265

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide?
The IUPAC name of N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide (CID 119106360) is N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide.
What is the SMILES notation for N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide?
The canonical SMILES for N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide is CN(Cc1ccnn1C)S(C)(=O)=O.
What is the InChIKey of N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide?
The InChIKey is ALXPQUGNAWNEKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2S/c1-9(13(3,11)12)6-7-4-5-8-10(7)2/h4-5H,6H2,1-3H3.
What are the key properties of N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide?
N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide has a molecular weight of 203.27 g/mol, XLogP of -0.19, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylpyrazol-3-yl)methyl]methanesulfonamide is sourced from PubChem (CID 119106360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).