2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide

C7H11N3O2S — CID 62786815

IUPAC2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide
SMILESCC(CO)NC(=O)c1csc(N)n1
InChIInChI=1S/C7H11N3O2S/c1-4(2-11)9-6(12)5-3-13-7(8)10-5/h3-4,11H,2H2,1H3,(H2,8,10)(H,9,12)
InChIKeyHYLVADFXHBQIGE-UHFFFAOYSA-N
MW201.25 g/mol
LogP-0.16
Rot. Bonds3

About 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide

2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide (PubChem CID 62786815) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide
PubChem CID62786815
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC Name2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide
SMILESCC(CO)NC(=O)c1csc(N)n1
InChIInChI=1S/C7H11N3O2S/c1-4(2-11)9-6(12)5-3-13-7(8)10-5/h3-4,11H,2H2,1H3,(H2,8,10)(H,9,12)
InChIKeyHYLVADFXHBQIGE-UHFFFAOYSA-N
XLogP-0.16
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-aminoethyl)-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide
CID 66375369
N-[(2S)-1-hydroxypropan-2-yl]-2-(methylamino)-1,3-thiazole-4-carboxamide
CID 130708869
2-amino-N-(1-phenylpropan-2-yl)-1,3-thiazole-4-carboxamide
CID 63010937
2-[(2-amino-1,3-thiazole-4-carbonyl)amino]-3-hydroxypropanoic acid
CID 62788085
2-amino-N-(5-hydroxy-4-methylpentyl)-1,3-thiazole-4-carboxamide
CID 106161214
N-(4-hydroxybutan-2-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 81048571
3-[(2-amino-1,3-thiazole-4-carbonyl)amino]-2-methylpropanoic acid
CID 62787414
2-amino-N-(2-methylbutyl)-1,3-thiazole-4-carboxamide
CID 62787415
2-amino-N-[1-(4-fluorophenyl)ethyl]-1,3-thiazole-4-carboxamide
CID 55116256
2-amino-N-[(1R)-1-(4-bromophenyl)ethyl]-1,3-thiazole-4-carboxamide
CID 81360148
N-[(2S)-1-aminopropan-2-yl]-2-methyl-1,3-thiazole-4-carboxamide;hydrochloride
CID 131019261
2-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 55115833

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide (CID 62786815) is 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide is CC(CO)NC(=O)c1csc(N)n1.
What is the InChIKey of 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is HYLVADFXHBQIGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-4(2-11)9-6(12)5-3-13-7(8)10-5/h3-4,11H,2H2,1H3,(H2,8,10)(H,9,12).
What are the key properties of 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide?
2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 201.25 g/mol, XLogP of -0.16, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 62786815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).