3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide

C16H17N3O3S2 — CID 33039939

IUPAC3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide
SMILESO=C(Nc1nc2c(s1)CCC2)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C16H17N3O3S2/c20-15(18-16-17-13-5-2-6-14(13)23-16)10-3-1-4-12(9-10)24(21,22)19-11-7-8-11/h1,3-4,9,11,19H,2,5-8H2,(H,17,18,20)
InChIKeyLGTYTQRWEQFDBL-UHFFFAOYSA-N
MW363.46 g/mol
LogP2.32
Rot. Bonds5

About 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide

3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide (PubChem CID 33039939) has the molecular formula C16H17N3O3S2 and a molecular weight of 363.46 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide
PubChem CID33039939
Molecular FormulaC16H17N3O3S2
Molecular Weight363.46 g/mol
Exact Mass363.07
IUPAC Name3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide
SMILESO=C(Nc1nc2c(s1)CCC2)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C16H17N3O3S2/c20-15(18-16-17-13-5-2-6-14(13)23-16)10-3-1-4-12(9-10)24(21,22)19-11-7-8-11/h1,3-4,9,11,19H,2,5-8H2,(H,17,18,20)
InChIKeyLGTYTQRWEQFDBL-UHFFFAOYSA-N
XLogP2.32
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(benzenesulfonamido)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide
CID 7541935
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-piperidin-1-ylsulfonylbenzamide
CID 9438598
3-(diethylsulfamoyl)-N-(4,5,6,7,8,9-hexahydrocycloocta[d][1,3]thiazol-2-yl)benzamide
CID 60571694
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide
CID 5140427
3-[methyl(phenyl)sulfamoyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide
CID 2595039
3-(cyclopropylsulfamoyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide
CID 32624601
3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
CID 166188646
3-ethylsulfonyl-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide
CID 43981130
ethyl 2-[[3-(cyclopropylsulfamoyl)benzoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate
CID 18227741
3-(2,3-dihydroindol-1-ylsulfonyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide
CID 2492615
methyl 2-[[3-(cyclopropylsulfamoyl)benzoyl]amino]-1,3-thiazole-5-carboxylate
CID 18287628
3-(cyclopropylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 27700197

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide?
The IUPAC name of 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide (CID 33039939) is 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide.
What is the SMILES notation for 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide?
The canonical SMILES for 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide is O=C(Nc1nc2c(s1)CCC2)c1cccc(S(=O)(=O)NC2CC2)c1.
What is the InChIKey of 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide?
The InChIKey is LGTYTQRWEQFDBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3S2/c20-15(18-16-17-13-5-2-6-14(13)23-16)10-3-1-4-12(9-10)24(21,22)19-11-7-8-11/h1,3-4,9,11,19H,2,5-8H2,(H,17,18,20).
What are the key properties of 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide?
3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide has a molecular weight of 363.46 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylsulfamoyl)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzamide is sourced from PubChem (CID 33039939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).