1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea

C7H11N3O2S — CID 130645718

IUPAC1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea
SMILESCNC(=O)Nc1ncc(COC)s1
InChIInChI=1S/C7H11N3O2S/c1-8-6(11)10-7-9-3-5(13-7)4-12-2/h3H,4H2,1-2H3,(H2,8,9,10,11)
InChIKeyFZOIJWFWKXCDLS-UHFFFAOYSA-N
MW201.25 g/mol
LogP1.04
Rot. Bonds3

About 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea

1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea (PubChem CID 130645718) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea.

Molecular Properties

Compound Name1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea
PubChem CID130645718
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC Name1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea
SMILESCNC(=O)Nc1ncc(COC)s1
InChIInChI=1S/C7H11N3O2S/c1-8-6(11)10-7-9-3-5(13-7)4-12-2/h3H,4H2,1-2H3,(H2,8,9,10,11)
InChIKeyFZOIJWFWKXCDLS-UHFFFAOYSA-N
XLogP1.04
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-3-(5-methyl-1,3-thiazol-2-yl)urea
CID 59293942
3-fluoro-N-[5-(methoxymethyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 136545116
1-(6,7-dihydro-4H-pyrano[3,4-d][1,2]oxazol-3-ylmethyl)-3-[5-(methoxymethyl)-1,3-thiazol-2-yl]urea
CID 138025312
(5-ethyl-1,3-thiazol-2-yl)carbamic acid
CID 90989275
(2S,3R)-N-[5-(methoxymethyl)-1,3-thiazol-2-yl]-1-methyl-2-phenylpyrrolidine-3-carboxamide
CID 127266159
N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-3-(methoxymethyl)benzamide
CID 42353300
2-(6-chloro-1-benzofuran-3-yl)-N-[5-(methoxymethyl)-1,3-thiazol-2-yl]acetamide
CID 142495562
N-(5-ethyl-1,3-thiazol-2-yl)-2-(2-methoxyethylamino)acetamide
CID 119755328
[2-(methylcarbamoylamino)-1,3-thiazol-5-yl] thiocyanate
CID 130009910
N-[5-[(4-cyanophenyl)methyl]-1,3-thiazol-2-yl]-3-(methoxymethyl)benzamide
CID 86920266
2-[4-[dihydroxy(3-methoxypropyl)-λ4-sulfanyl]phenyl]-2-imino-N-[5-(methoxymethyl)-1,3-thiazol-2-yl]acetamide
CID 143392593
N-(5-benzyl-1,3-thiazol-2-yl)-3,5-dimethoxybenzamide
CID 52896563

Frequently Asked Questions

What is the IUPAC name of 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea?
The IUPAC name of 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea (CID 130645718) is 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea.
What is the SMILES notation for 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea?
The canonical SMILES for 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea is CNC(=O)Nc1ncc(COC)s1.
What is the InChIKey of 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea?
The InChIKey is FZOIJWFWKXCDLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-8-6(11)10-7-9-3-5(13-7)4-12-2/h3H,4H2,1-2H3,(H2,8,9,10,11).
What are the key properties of 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea?
1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea has a molecular weight of 201.25 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(methoxymethyl)-1,3-thiazol-2-yl]-3-methylurea is sourced from PubChem (CID 130645718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).