4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide

C14H18N4O3S2 — CID 120563834

IUPAC4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide
SMILESCC(N)CCC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1
InChIInChI=1S/C14H18N4O3S2/c1-10(15)5-6-13(19)17-11-3-2-4-12(9-11)23(20,21)18-14-16-7-8-22-14/h2-4,7-10H,5-6,15H2,1H3,(H,16,18)(H,17,19)
InChIKeySVXWGVUAXIYKLZ-UHFFFAOYSA-N
MW354.46 g/mol
LogP2.01
Rot. Bonds7

About 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide

4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide (PubChem CID 120563834) has the molecular formula C14H18N4O3S2 and a molecular weight of 354.46 g/mol. Its IUPAC name is 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide
PubChem CID120563834
Molecular FormulaC14H18N4O3S2
Molecular Weight354.46 g/mol
Exact Mass354.08
IUPAC Name4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide
SMILESCC(N)CCC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1
InChIInChI=1S/C14H18N4O3S2/c1-10(15)5-6-13(19)17-11-3-2-4-12(9-11)23(20,21)18-14-16-7-8-22-14/h2-4,7-10H,5-6,15H2,1H3,(H,16,18)(H,17,19)
InChIKeySVXWGVUAXIYKLZ-UHFFFAOYSA-N
XLogP2.01
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-2-methyl-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide
CID 120502083
3-amino-2-methyl-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide;hydrochloride
CID 120502082
4-amino-3-methoxy-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide
CID 120594010
(2S)-2-amino-4-methylsulfanyl-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide
CID 119341542
2-amino-2-methyl-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide;hydrochloride
CID 119814954
3-(ethylamino)-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 114263537
1-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119341551
3-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 25044262
3-(4-propan-2-ylphenyl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]propanamide
CID 19221513
3-(ethoxymethyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 71689341
4-amino-N-[3-(methanesulfonamido)phenyl]pentanamide;hydrochloride
CID 120559877
ethane;4-hydroxy-2-methyl-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide
CID 90981855

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide?
The IUPAC name of 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide (CID 120563834) is 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide.
What is the SMILES notation for 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide?
The canonical SMILES for 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide is CC(N)CCC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1.
What is the InChIKey of 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide?
The InChIKey is SVXWGVUAXIYKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3S2/c1-10(15)5-6-13(19)17-11-3-2-4-12(9-11)23(20,21)18-14-16-7-8-22-14/h2-4,7-10H,5-6,15H2,1H3,(H,16,18)(H,17,19).
What are the key properties of 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide?
4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide has a molecular weight of 354.46 g/mol, XLogP of 2.01, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]pentanamide is sourced from PubChem (CID 120563834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).