(5-methyl-1,3-thiazol-2-yl)urea

C5H7N3OS — CID 16789902

IUPAC(5-methyl-1,3-thiazol-2-yl)urea
SMILESCc1cnc(NC(N)=O)s1
InChIInChI=1S/C5H7N3OS/c1-3-2-7-5(10-3)8-4(6)9/h2H,1H3,(H3,6,7,8,9)
InChIKeyZBEMMRDSEPRUNF-UHFFFAOYSA-N
MW157.20 g/mol
LogP0.94
Rot. Bonds1

About (5-methyl-1,3-thiazol-2-yl)urea

(5-methyl-1,3-thiazol-2-yl)urea (PubChem CID 16789902) has the molecular formula C5H7N3OS and a molecular weight of 157.20 g/mol. Its IUPAC name is (5-methyl-1,3-thiazol-2-yl)urea.

Molecular Properties

Compound Name(5-methyl-1,3-thiazol-2-yl)urea
PubChem CID16789902
Molecular FormulaC5H7N3OS
Molecular Weight157.20 g/mol
Exact Mass157.03
IUPAC Name(5-methyl-1,3-thiazol-2-yl)urea
SMILESCc1cnc(NC(N)=O)s1
InChIInChI=1S/C5H7N3OS/c1-3-2-7-5(10-3)8-4(6)9/h2H,1H3,(H3,6,7,8,9)
InChIKeyZBEMMRDSEPRUNF-UHFFFAOYSA-N
XLogP0.94
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.20
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-5-methylthiazole
CID 351770
O-ethyl [2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanylmethanethioate
CID 1796567
N-(3,4-Dihydro-2H-pyrrol-5-yl)-5-methylthiazol-2-amine
CID 2101061
2-Acetamido-5-methylthiazole
CID 298507
2-Chloro-N-(5-methyl-thiazol-2-yl)-acetamide
CID 846121
N-(5-methyl-1,3-thiazol-2-yl)pyrrolidine-1-carboxamide
CID 47197229
2-Thiazolamine, N-methyl-5-(trifluoromethyl)-
CID 11074029
5-[(Hydroxyimino)methyl]-1,3-thiazol-2-amine
CID 50989696
2-Amino-5-methyl-1,3-thiazol-3-ium
CID 4469369
N-(5-methyl-1,3-thiazol-2-yl)azepane-1-carboxamide
CID 47197239
5-methyl-N-prop-2-enyl-1,3-thiazol-2-amine
CID 3101501
N,5-dimethylthiazol-2-amine
CID 817028

Frequently Asked Questions

What is the IUPAC name of (5-methyl-1,3-thiazol-2-yl)urea?
The IUPAC name of (5-methyl-1,3-thiazol-2-yl)urea (CID 16789902) is (5-methyl-1,3-thiazol-2-yl)urea.
What is the SMILES notation for (5-methyl-1,3-thiazol-2-yl)urea?
The canonical SMILES for (5-methyl-1,3-thiazol-2-yl)urea is Cc1cnc(NC(N)=O)s1.
What is the InChIKey of (5-methyl-1,3-thiazol-2-yl)urea?
The InChIKey is ZBEMMRDSEPRUNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3OS/c1-3-2-7-5(10-3)8-4(6)9/h2H,1H3,(H3,6,7,8,9).
What are the key properties of (5-methyl-1,3-thiazol-2-yl)urea?
(5-methyl-1,3-thiazol-2-yl)urea has a molecular weight of 157.20 g/mol, XLogP of 0.94, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-1,3-thiazol-2-yl)urea is sourced from PubChem (CID 16789902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).