N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide

C10H16N6O2S — CID 72932662

IUPACN-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide
SMILESCN(CCn1cc(-c2nccn2C)nn1)S(C)(=O)=O
InChIInChI=1S/C10H16N6O2S/c1-14-5-4-11-10(14)9-8-16(13-12-9)7-6-15(2)19(3,17)18/h4-5,8H,6-7H2,1-3H3
InChIKeyXRTGHPCLDGMRAC-UHFFFAOYSA-N
MW284.35 g/mol
LogP-0.43
Rot. Bonds5

About N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide

N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide (PubChem CID 72932662) has the molecular formula C10H16N6O2S and a molecular weight of 284.35 g/mol. Its IUPAC name is N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide
PubChem CID72932662
Molecular FormulaC10H16N6O2S
Molecular Weight284.35 g/mol
Exact Mass284.11
IUPAC NameN-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide
SMILESCN(CCn1cc(-c2nccn2C)nn1)S(C)(=O)=O
InChIInChI=1S/C10H16N6O2S/c1-14-5-4-11-10(14)9-8-16(13-12-9)7-6-15(2)19(3,17)18/h4-5,8H,6-7H2,1-3H3
InChIKeyXRTGHPCLDGMRAC-UHFFFAOYSA-N
XLogP-0.43
TPSA85.91 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.35
LogP ≤ 5-0.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N-[2-(5'-methyl-1H,3'H-2,4'-biimidazol-1-yl)ethyl]methanesulfonamide
CID 70754226
8-methyl-7-methylsulfonyl-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 118744607
2-(2'-butyl-1H,1'H-2,4'-biimidazol-1-yl)-N,N-dimethylethanesulfonamide
CID 70765430
1-methyl-4-[(2S)-1-[4-(1-propylimidazol-2-yl)triazol-1-yl]propan-2-yl]piperazine
CID 97130706
7-methylsulfonyl-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97382091
7-ethylsulfonyl-2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97382092
7-ethylsulfonyl-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97411639
7-methylsulfonyl-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97415886
7-Ethylsulfonyl-3-(pyrazol-1-ylmethyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine
CID 97467118
7-Propylsulfonyl-3-(pyrazol-1-ylmethyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine
CID 97467119
7-Butylsulfonyl-3-(pyrazol-1-ylmethyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine
CID 97467122
7-Propylsulfonyl-3-(1,2,4-triazol-1-ylmethyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine
CID 97467155

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide?
The IUPAC name of N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide (CID 72932662) is N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide.
What is the SMILES notation for N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide?
The canonical SMILES for N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide is CN(CCn1cc(-c2nccn2C)nn1)S(C)(=O)=O.
What is the InChIKey of N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide?
The InChIKey is XRTGHPCLDGMRAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6O2S/c1-14-5-4-11-10(14)9-8-16(13-12-9)7-6-15(2)19(3,17)18/h4-5,8H,6-7H2,1-3H3.
What are the key properties of N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide?
N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide has a molecular weight of 284.35 g/mol, XLogP of -0.43, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-[4-(1-methylimidazol-2-yl)triazol-1-yl]ethyl]methanesulfonamide is sourced from PubChem (CID 72932662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).