(2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate

C7H10N2O2S — CID 3042843

IUPAC(2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate
SMILESCNC(=O)OCc1cnc(C)s1
InChIInChI=1S/C7H10N2O2S/c1-5-9-3-6(12-5)4-11-7(10)8-2/h3H,4H2,1-2H3,(H,8,10)
InChIKeyPWBSNIGCZNXABS-UHFFFAOYSA-N
MW186.24 g/mol
LogP1.31
Rot. Bonds2

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

(2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate (PubChem CID 3042843) has the molecular formula C7H10N2O2S and a molecular weight of 186.24 g/mol. Its IUPAC name is (2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate.

Molecular Properties

Compound Name(2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate
PubChem CID3042843
Molecular FormulaC7H10N2O2S
Molecular Weight186.24 g/mol
Exact Mass186.05
IUPAC Name(2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate
SMILESCNC(=O)OCc1cnc(C)s1
InChIInChI=1S/C7H10N2O2S/c1-5-9-3-6(12-5)4-11-7(10)8-2/h3H,4H2,1-2H3,(H,8,10)
InChIKeyPWBSNIGCZNXABS-UHFFFAOYSA-N
XLogP1.31
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.24
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate?
The IUPAC name of (2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate (CID 3042843) is (2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate.
What is the SMILES notation for (2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate?
The canonical SMILES for (2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate is CNC(=O)OCc1cnc(C)s1.
What is the InChIKey of (2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate?
The InChIKey is PWBSNIGCZNXABS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2S/c1-5-9-3-6(12-5)4-11-7(10)8-2/h3H,4H2,1-2H3,(H,8,10).
What are the key properties of (2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate?
(2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate has a molecular weight of 186.24 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-1,3-thiazol-5-yl)methyl N-methylcarbamate is sourced from PubChem (CID 3042843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).