2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide

C10H17N3O3S2 — CID 75396908

IUPAC2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)NCC(C)S(N)(=O)=O)s1
InChIInChI=1S/C10H17N3O3S2/c1-3-4-9-12-6-8(17-9)10(14)13-5-7(2)18(11,15)16/h6-7H,3-5H2,1-2H3,(H,13,14)(H2,11,15,16)
InChIKeyUPLLHYWFPPCTHH-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.50
Rot. Bonds6

About 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide

2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide (PubChem CID 75396908) has the molecular formula C10H17N3O3S2 and a molecular weight of 291.40 g/mol. Its IUPAC name is 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide
PubChem CID75396908
Molecular FormulaC10H17N3O3S2
Molecular Weight291.40 g/mol
Exact Mass291.07
IUPAC Name2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)NCC(C)S(N)(=O)=O)s1
InChIInChI=1S/C10H17N3O3S2/c1-3-4-9-12-6-8(17-9)10(14)13-5-7(2)18(11,15)16/h6-7H,3-5H2,1-2H3,(H,13,14)(H2,11,15,16)
InChIKeyUPLLHYWFPPCTHH-UHFFFAOYSA-N
XLogP0.50
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N,2-dimethyl-1,3-thiazole-5-carboxamide
CID 47002207
N-(2-acetamidoethyl)-2-tert-butyl-1,3-thiazole-5-carboxamide
CID 47398670
2-tert-butyl-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-5-carboxamide
CID 47404403
2-tert-butyl-N-(2-sulfamoylethyl)-1,3-thiazole-5-carboxamide
CID 47925770
2-ethyl-N-(2-methylbutan-2-yl)-1,3-thiazole-5-carboxamide
CID 48571573
2-tert-butyl-N-[2-(diethylamino)ethyl]-1,3-thiazole-5-carboxamide
CID 53516078
1-Methylsulfonyl-4-(1,3-thiazole-5-carbonyl)-1,4-diazepane-6-carboxamide
CID 118739890
2-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-5-carboxamide
CID 53537744
N-(2-ethylsulfonylethyl)-2-methyl-1,3-thiazole-5-carboxamide
CID 60231579
N-((1r,4r)-4-aminocyclohexyl)-2-ethylthiazole-5-carboxamide
CID 132227597
2-ethyl-N-methylsulfonyl-1,3-thiazole-5-carboxamide
CID 47425444
4-Amino-2-(methylsulfanyl)-N-pentylthiazole-5-carboxamide
CID 162393170

Frequently Asked Questions

What is the IUPAC name of 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide (CID 75396908) is 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide is CCCc1ncc(C(=O)NCC(C)S(N)(=O)=O)s1.
What is the InChIKey of 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide?
The InChIKey is UPLLHYWFPPCTHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S2/c1-3-4-9-12-6-8(17-9)10(14)13-5-7(2)18(11,15)16/h6-7H,3-5H2,1-2H3,(H,13,14)(H2,11,15,16).
What are the key properties of 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide?
2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 0.50, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-N-(2-sulfamoylpropyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 75396908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).