N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine

C12H16N4O2S2 — CID 110624920

IUPACN-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine
SMILESCCNS(=O)(=O)NCCc1csc(-c2ccccn2)n1
InChIInChI=1S/C12H16N4O2S2/c1-2-14-20(17,18)15-8-6-10-9-19-12(16-10)11-5-3-4-7-13-11/h3-5,7,9,14-15H,2,6,8H2,1H3
InChIKeyGHVWJXDIZWZOLS-UHFFFAOYSA-N
MW312.42 g/mol
LogP1.19
Rot. Bonds7

About N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine

N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine (PubChem CID 110624920) has the molecular formula C12H16N4O2S2 and a molecular weight of 312.42 g/mol. Its IUPAC name is N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine.

Molecular Properties

Compound NameN-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine
PubChem CID110624920
Molecular FormulaC12H16N4O2S2
Molecular Weight312.42 g/mol
Exact Mass312.07
IUPAC NameN-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine
SMILESCCNS(=O)(=O)NCCc1csc(-c2ccccn2)n1
InChIInChI=1S/C12H16N4O2S2/c1-2-14-20(17,18)15-8-6-10-9-19-12(16-10)11-5-3-4-7-13-11/h3-5,7,9,14-15H,2,6,8H2,1H3
InChIKeyGHVWJXDIZWZOLS-UHFFFAOYSA-N
XLogP1.19
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine
CID 110624843
4-fluoro-3-methyl-N-[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethyl]benzenesulfonamide
CID 110284985
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)propanamide
CID 110406547
2-methylsulfonyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 47267496
4-[(5-methylpyrimidin-2-yl)sulfonylmethyl]-2-pyridin-2-yl-1,3-thiazole
CID 75471583
2-(4-ethoxyphenyl)-N-[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethyl]acetamide
CID 110284963
4-(2,2-dimethylpropylsulfonylmethyl)-2-pyridin-2-yl-1,3-thiazole
CID 122140520
3-methylsulfinyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]propan-1-amine
CID 115632903
N-[2-(ethylamino)ethyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide;dihydrochloride
CID 119506122
N-(2,6-dimethylphenyl)-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)propanamide
CID 110418418
N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]octan-1-amine
CID 78921085
N-butyl-N-methyl-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)propanamide
CID 110329792

Frequently Asked Questions

What is the IUPAC name of N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine?
The IUPAC name of N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine (CID 110624920) is N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine.
What is the SMILES notation for N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine?
The canonical SMILES for N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine is CCNS(=O)(=O)NCCc1csc(-c2ccccn2)n1.
What is the InChIKey of N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine?
The InChIKey is GHVWJXDIZWZOLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O2S2/c1-2-14-20(17,18)15-8-6-10-9-19-12(16-10)11-5-3-4-7-13-11/h3-5,7,9,14-15H,2,6,8H2,1H3.
What are the key properties of N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine?
N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine has a molecular weight of 312.42 g/mol, XLogP of 1.19, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine is sourced from PubChem (CID 110624920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).