2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine

C13H22N4O2S2 — CID 43593454

IUPAC2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
SMILESCN(C1CCCCC1)S(=O)(=O)Nc1nc2c(s1)CNCC2
InChIInChI=1S/C13H22N4O2S2/c1-17(10-5-3-2-4-6-10)21(18,19)16-13-15-11-7-8-14-9-12(11)20-13/h10,14H,2-9H2,1H3,(H,15,16)
InChIKeyUOYRSISYFIMBCH-UHFFFAOYSA-N
MW330.48 g/mol
LogP1.71
Rot. Bonds4

About 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine

2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine (PubChem CID 43593454) has the molecular formula C13H22N4O2S2 and a molecular weight of 330.48 g/mol. Its IUPAC name is 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine.

Molecular Properties

Compound Name2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
PubChem CID43593454
Molecular FormulaC13H22N4O2S2
Molecular Weight330.48 g/mol
Exact Mass330.12
IUPAC Name2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
SMILESCN(C1CCCCC1)S(=O)(=O)Nc1nc2c(s1)CNCC2
InChIInChI=1S/C13H22N4O2S2/c1-17(10-5-3-2-4-6-10)21(18,19)16-13-15-11-7-8-14-9-12(11)20-13/h10,14H,2-9H2,1H3,(H,15,16)
InChIKeyUOYRSISYFIMBCH-UHFFFAOYSA-N
XLogP1.71
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine with MolForge

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Related Compounds

5-methyl-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridin-2-amine
CID 2397998
5-Ethyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-2-amine
CID 2084043
1-Ethyl-3-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)urea
CID 43593384
Thiazolo(5,4-c)pyridine-5(4H)-carboxamide, 6,7-dihydro-2-((aminoiminomethyl)amino)-N-cyclohexyl-
CID 3062335
Thiazolo(5,4-c)pyridine-5(4H)-carboxamide, 6,7-dihydro-2-((aminoiminomethyl)amino)-N-ethyl-
CID 3062336
Thiazolo(5,4-c)pyridine-5(4H)-carboxamide, 6,7-dihydro-2-((aminoiminomethyl)amino)-N-butyl-
CID 3062337
Thiazolo(5,4-c)pyridine-5(4H)-carboxamide, 6,7-dihydro-2-((aminoiminomethyl)amino)-N-(1-methylethyl)-
CID 3062338
Thiazolo(5,4-c)pyridine-5(4H)-carbothioamide, 6,7-dihydro-2-((aminoiminomethyl)amino)-N-(1-methylethyl)-
CID 3062339
Thiazolo(5,4-c)pyridine-5(4H)-carboxamide, 6,7-dihydro-2-((aminoiminomethyl)amino)-N-propyl-
CID 3062353
Guanidine, (5-(4-(methylamino)-1,2,5-thiadiazolidin-3-yl)-4,5,6,7-tetrahydrothiazolo(5,4-c)pyridin-2-yl)-, S,S-dioxide
CID 3088604
Urea, N-(2-(2-((aminoiminomethyl)amino)-6,7-dihydrothiazolo(5,4-c)pyridin-5(4H)-yl)ethyl)-N'-(1-methylethyl)-
CID 3088605
4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridin-2-amine
CID 13519687

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
The IUPAC name of 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine (CID 43593454) is 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine.
What is the SMILES notation for 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
The canonical SMILES for 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine is CN(C1CCCCC1)S(=O)(=O)Nc1nc2c(s1)CNCC2.
What is the InChIKey of 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
The InChIKey is UOYRSISYFIMBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2S2/c1-17(10-5-3-2-4-6-10)21(18,19)16-13-15-11-7-8-14-9-12(11)20-13/h10,14H,2-9H2,1H3,(H,15,16).
What are the key properties of 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine has a molecular weight of 330.48 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclohexyl(methyl)sulfamoyl]amino]-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine is sourced from PubChem (CID 43593454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).