5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide

C11H15N5O2S — CID 63979640

IUPAC5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide
SMILESCN(Cc1ccccn1)S(=O)(=O)c1c(N)ncn1C
InChIInChI=1S/C11H15N5O2S/c1-15-8-14-10(12)11(15)19(17,18)16(2)7-9-5-3-4-6-13-9/h3-6,8H,7,12H2,1-2H3
InChIKeyKKERWNQKBFYOBV-UHFFFAOYSA-N
MW281.34 g/mol
LogP0.22
Rot. Bonds4

About 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide

5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide (PubChem CID 63979640) has the molecular formula C11H15N5O2S and a molecular weight of 281.34 g/mol. Its IUPAC name is 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide
PubChem CID63979640
Molecular FormulaC11H15N5O2S
Molecular Weight281.34 g/mol
Exact Mass281.09
IUPAC Name5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide
SMILESCN(Cc1ccccn1)S(=O)(=O)c1c(N)ncn1C
InChIInChI=1S/C11H15N5O2S/c1-15-8-14-10(12)11(15)19(17,18)16(2)7-9-5-3-4-6-13-9/h3-6,8H,7,12H2,1-2H3
InChIKeyKKERWNQKBFYOBV-UHFFFAOYSA-N
XLogP0.22
TPSA94.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-N,3-dimethyl-N-(2-phenylethyl)imidazole-4-sulfonamide
CID 63980403
5-amino-N-benzyl-N-cyclopropyl-3-methylimidazole-4-sulfonamide
CID 63979084
5-amino-N-(2-methoxyethyl)-N,3-dimethylimidazole-4-sulfonamide
CID 63978509
4-amino-2,6-dibromo-N-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 43564889
5-amino-N,3-dimethyl-N-(3-methylsulfanylpropyl)imidazole-4-sulfonamide
CID 114236541
3-amino-4-chloro-N-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 43564918
4-tert-butyl-N-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 110724675
1-chloro-N-methyl-N-(pyridin-2-ylmethyl)methanesulfonamide
CID 63666756
3-amino-4-fluoro-N,5-dimethyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 115421252
5-amino-2-chloro-4-fluoro-N-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 61113797
3-amino-2-bromo-5-chloro-N-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 62957761
3-hydroxy-N-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 81259129

Frequently Asked Questions

What is the IUPAC name of 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide?
The IUPAC name of 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide (CID 63979640) is 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide?
The canonical SMILES for 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide is CN(Cc1ccccn1)S(=O)(=O)c1c(N)ncn1C.
What is the InChIKey of 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide?
The InChIKey is KKERWNQKBFYOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2S/c1-15-8-14-10(12)11(15)19(17,18)16(2)7-9-5-3-4-6-13-9/h3-6,8H,7,12H2,1-2H3.
What are the key properties of 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide?
5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide has a molecular weight of 281.34 g/mol, XLogP of 0.22, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N,3-dimethyl-N-(pyridin-2-ylmethyl)imidazole-4-sulfonamide is sourced from PubChem (CID 63979640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).