1,3-thiazol-2-yl N-ethyl-N-methylcarbamate

C7H10N2O2S — CID 174620445

IUPAC1,3-thiazol-2-yl N-ethyl-N-methylcarbamate
SMILESCCN(C)C(=O)Oc1nccs1
InChIInChI=1S/C7H10N2O2S/c1-3-9(2)7(10)11-6-8-4-5-12-6/h4-5H,3H2,1-2H3
InChIKeyMSCFXQLXNOTRSU-UHFFFAOYSA-N
MW186.24 g/mol
LogP1.59
Rot. Bonds2

About 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate

1,3-thiazol-2-yl N-ethyl-N-methylcarbamate (PubChem CID 174620445) has the molecular formula C7H10N2O2S and a molecular weight of 186.24 g/mol. Its IUPAC name is 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate.

Molecular Properties

Compound Name1,3-thiazol-2-yl N-ethyl-N-methylcarbamate
PubChem CID174620445
Molecular FormulaC7H10N2O2S
Molecular Weight186.24 g/mol
Exact Mass186.05
IUPAC Name1,3-thiazol-2-yl N-ethyl-N-methylcarbamate
SMILESCCN(C)C(=O)Oc1nccs1
InChIInChI=1S/C7H10N2O2S/c1-3-9(2)7(10)11-6-8-4-5-12-6/h4-5H,3H2,1-2H3
InChIKeyMSCFXQLXNOTRSU-UHFFFAOYSA-N
XLogP1.59
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.24
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-O-ethyl 3-O-(1,3-thiazol-2-yl) propanedioate
CID 174640375
1-ethyl-1-methyl-3-(1,3-thiazol-2-yl)urea
CID 115603490
5-O-amino 1-O-(1,3-thiazol-2-yl) pentanedioate
CID 70426557
1-(1,3-thiazol-2-yl)pentan-3-one
CID 58326627
N-methyl-N-(1,3-thiazol-2-ylmethyl)prop-2-ynamide
CID 130614901
ethyl N-amino-N-(1,3-thiazol-2-yl)carbamate
CID 175372903
2-butoxy-1,3-thiazole;propane
CID 143891119
(3,5-ditert-butylphenyl) N-ethyl-N-methylcarbamate
CID 68735329
phenyl N-methyl-N-(1,3-thiazol-2-yl)carbamate
CID 110723371
ethyl 2-[methyl(1,3-thiazol-2-ylmethyl)amino]acetate
CID 79421858
(2,5-diamino-6-propoxypyrimidin-4-yl) N-ethyl-N-methylcarbamate
CID 122601847
3-ethyl-1-methyl-1-[2-(1,3-thiazol-2-yl)ethyl]urea
CID 75387967

Frequently Asked Questions

What is the IUPAC name of 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate?
The IUPAC name of 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate (CID 174620445) is 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate.
What is the SMILES notation for 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate?
The canonical SMILES for 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate is CCN(C)C(=O)Oc1nccs1.
What is the InChIKey of 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate?
The InChIKey is MSCFXQLXNOTRSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2S/c1-3-9(2)7(10)11-6-8-4-5-12-6/h4-5H,3H2,1-2H3.
What are the key properties of 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate?
1,3-thiazol-2-yl N-ethyl-N-methylcarbamate has a molecular weight of 186.24 g/mol, XLogP of 1.59, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-thiazol-2-yl N-ethyl-N-methylcarbamate is sourced from PubChem (CID 174620445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).