N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide

C14H21N5O2S — CID 91911671

IUPACN-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide
SMILESCc1cnc(CCNS(=O)(=O)c2cn(C)cn2)n1C1CCC1
InChIInChI=1S/C14H21N5O2S/c1-11-8-15-13(19(11)12-4-3-5-12)6-7-17-22(20,21)14-9-18(2)10-16-14/h8-10,12,17H,3-7H2,1-2H3
InChIKeyGVNDUXGDNNGOCH-UHFFFAOYSA-N
MW323.42 g/mol
LogP1.17
Rot. Bonds6

About N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide

N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide (PubChem CID 91911671) has the molecular formula C14H21N5O2S and a molecular weight of 323.42 g/mol. Its IUPAC name is N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide.

Molecular Properties

Compound NameN-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide
PubChem CID91911671
Molecular FormulaC14H21N5O2S
Molecular Weight323.42 g/mol
Exact Mass323.14
IUPAC NameN-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide
SMILESCc1cnc(CCNS(=O)(=O)c2cn(C)cn2)n1C1CCC1
InChIInChI=1S/C14H21N5O2S/c1-11-8-15-13(19(11)12-4-3-5-12)6-7-17-22(20,21)14-9-18(2)10-16-14/h8-10,12,17H,3-7H2,1-2H3
InChIKeyGVNDUXGDNNGOCH-UHFFFAOYSA-N
XLogP1.17
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide 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-{2-[5-Methyl-1-(propan-2-YL)-1H-imidazol-2-YL]ethyl}propane-1-sulfonamide
CID 91923976
N-[2-(1-cyclobutyl-5-methyl-1H-imidazol-2-yl)ethyl]-1-ethyl-1H-pyrazole-4-sulfonamide
CID 91911673
N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide
CID 91923843
1-methyl-1H-imidazol-4-yl [3-(5-methyl-1-propyl-1H-imidazol-2-yl)-1-pyrrolidinyl] sulfone
CID 91923874
5-Methyl-2-[1-(1-methylimidazol-4-yl)sulfonylpyrrolidin-3-yl]-1-propan-2-ylimidazole
CID 91923881
N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-1-methylimidazole-4-sulfonamide
CID 91923965
5-Methyl-2-[[1-(1-methylimidazol-4-yl)sulfonylpyrrolidin-3-yl]methyl]-1-propan-2-ylimidazole
CID 124046162
N-{2-[5-Methyl-1-(propan-2-YL)-1H-imidazol-2-YL]ethyl}ethane-1-sulfonamide
CID 124056550
N-[2-(1-Cyclobutyl-5-methyl-1H-imidazol-2-YL)ethyl]propane-2-sulfonamide
CID 124060950
N-[2-(1-Cyclobutyl-5-methyl-1H-imidazol-2-YL)ethyl]ethane-1-sulfonamide
CID 124065287
1-propan-2-yl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide
CID 129002339
1,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide
CID 129005385

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide?
The IUPAC name of N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide (CID 91911671) is N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide.
What is the SMILES notation for N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide?
The canonical SMILES for N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide is Cc1cnc(CCNS(=O)(=O)c2cn(C)cn2)n1C1CCC1.
What is the InChIKey of N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide?
The InChIKey is GVNDUXGDNNGOCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2S/c1-11-8-15-13(19(11)12-4-3-5-12)6-7-17-22(20,21)14-9-18(2)10-16-14/h8-10,12,17H,3-7H2,1-2H3.
What are the key properties of N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide?
N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide has a molecular weight of 323.42 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-cyclobutyl-5-methylimidazol-2-yl)ethyl]-1-methylimidazole-4-sulfonamide is sourced from PubChem (CID 91911671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).