2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide

C7H12N4O3S2 — CID 62788374

IUPAC2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide
SMILESCS(=O)(=O)NCCNC(=O)c1csc(N)n1
InChIInChI=1S/C7H12N4O3S2/c1-16(13,14)10-3-2-9-6(12)5-4-15-7(8)11-5/h4,10H,2-3H2,1H3,(H2,8,11)(H,9,12)
InChIKeyLYDIVDLZRBDWMM-UHFFFAOYSA-N
MW264.33 g/mol
LogP-1.00
Rot. Bonds5

About 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide

2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide (PubChem CID 62788374) has the molecular formula C7H12N4O3S2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide
PubChem CID62788374
Molecular FormulaC7H12N4O3S2
Molecular Weight264.33 g/mol
Exact Mass264.04
IUPAC Name2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide
SMILESCS(=O)(=O)NCCNC(=O)c1csc(N)n1
InChIInChI=1S/C7H12N4O3S2/c1-16(13,14)10-3-2-9-6(12)5-4-15-7(8)11-5/h4,10H,2-3H2,1H3,(H2,8,11)(H,9,12)
InChIKeyLYDIVDLZRBDWMM-UHFFFAOYSA-N
XLogP-1.00
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-1.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-acetamidoethyl)-2-amino-1,3-thiazole-4-carboxamide
CID 62788552
2-amino-N-[2-[(4-methylbenzoyl)amino]ethyl]-1,3-thiazole-4-carboxamide
CID 62788957
methyl 3-[(2-amino-1,3-thiazole-4-carbonyl)amino]propanoate
CID 62787060
2-amino-N-[3-(diethylamino)propyl]-1,3-thiazole-4-carboxamide
CID 55116109
2-amino-N-prop-2-ynyl-1,3-thiazole-4-carboxamide
CID 62788887
2-amino-N-(4,4,4-trifluorobutyl)-1,3-thiazole-4-carboxamide
CID 115519247
2-amino-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 122567185
2-amino-N-(5-hydroxy-4-methylpentyl)-1,3-thiazole-4-carboxamide
CID 106161214
2-amino-N-(3-pyrrolidin-1-ylpropyl)-1,3-thiazole-4-carboxamide
CID 62787661
2-[2-[(2-amino-1,3-thiazole-4-carbonyl)amino]ethoxy]acetic acid
CID 79457217
2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-thiazole-4-carboxamide
CID 62975755
2-amino-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-1,3-thiazole-4-carboxamide
CID 62845386

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide (CID 62788374) is 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide is CS(=O)(=O)NCCNC(=O)c1csc(N)n1.
What is the InChIKey of 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide?
The InChIKey is LYDIVDLZRBDWMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O3S2/c1-16(13,14)10-3-2-9-6(12)5-4-15-7(8)11-5/h4,10H,2-3H2,1H3,(H2,8,11)(H,9,12).
What are the key properties of 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide?
2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide has a molecular weight of 264.33 g/mol, XLogP of -1.00, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(methanesulfonamido)ethyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 62788374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).