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

C11H11N3OS — CID 34880183

IUPAC1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea
SMILESCN(C(=O)Nc1nccs1)c1ccccc1
InChIInChI=1S/C11H11N3OS/c1-14(9-5-3-2-4-6-9)11(15)13-10-12-7-8-16-10/h2-8H,1H3,(H,12,13,15)
InChIKeySWLHSLSHNIANAJ-UHFFFAOYSA-N
MW233.30 g/mol
LogP2.81
Rot. Bonds2

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

1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea (PubChem CID 34880183) has the molecular formula C11H11N3OS and a molecular weight of 233.30 g/mol. Its IUPAC name is 1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea.

Molecular Properties

Compound Name1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea
PubChem CID34880183
Molecular FormulaC11H11N3OS
Molecular Weight233.30 g/mol
Exact Mass233.06
IUPAC Name1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea
SMILESCN(C(=O)Nc1nccs1)c1ccccc1
InChIInChI=1S/C11H11N3OS/c1-14(9-5-3-2-4-6-9)11(15)13-10-12-7-8-16-10/h2-8H,1H3,(H,12,13,15)
InChIKeySWLHSLSHNIANAJ-UHFFFAOYSA-N
XLogP2.81
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-1-methyl-3-(1,3-thiazol-2-yl)urea
CID 127514333
1-ethyl-1-methyl-3-(1,3-thiazol-2-yl)urea
CID 115603490
2-[methyl(1,3-thiazol-2-ylcarbamoyl)amino]propanoic acid
CID 62625896
2-(dimethylamino)-2-phenyl-N-(1,3-thiazol-2-yl)acetamide
CID 47839437
1-benzyl-1-propan-2-yl-3-(1,3-thiazol-2-yl)urea
CID 47363759
1-methyl-1-nitroso-3-(1,3-thiazol-2-yl)urea;dihydrochloride
CID 174438670
N-(1,3-thiazol-2-yl)benzamide;hydrochloride
CID 141066064
2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide
CID 18134023
(2S)-2-phenyl-N-(1,3-thiazol-2-yl)propanamide
CID 97038201
1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-(1,3-thiazol-2-yl)urea
CID 47148467
1-methyl-1-prop-2-enyl-3-(1,3-thiazol-2-yl)urea
CID 131176329
1-[4-(7-methoxy-6-methylquinolin-4-yl)oxyphenyl]-1-methyl-3-(1,3-thiazol-2-yl)urea
CID 88925602

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea?
The IUPAC name of 1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea (CID 34880183) is 1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea.
What is the SMILES notation for 1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea?
The canonical SMILES for 1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea is CN(C(=O)Nc1nccs1)c1ccccc1.
What is the InChIKey of 1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea?
The InChIKey is SWLHSLSHNIANAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3OS/c1-14(9-5-3-2-4-6-9)11(15)13-10-12-7-8-16-10/h2-8H,1H3,(H,12,13,15).
What are the key properties of 1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea?
1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea has a molecular weight of 233.30 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea is sourced from PubChem (CID 34880183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).