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

C11H10N2O2S — CID 23361835

IUPACphenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate
SMILESCc1cc(NC(=O)Oc2ccccc2)sn1
InChIInChI=1S/C11H10N2O2S/c1-8-7-10(16-13-8)12-11(14)15-9-5-3-2-4-6-9/h2-7H,1H3,(H,12,14)
InChIKeyNDRJEJCOCPGDDA-UHFFFAOYSA-N
MW234.28 g/mol
LogP3.06
Rot. Bonds2

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

phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate (PubChem CID 23361835) has the molecular formula C11H10N2O2S and a molecular weight of 234.28 g/mol. Its IUPAC name is phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate.

Molecular Properties

Compound Namephenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate
PubChem CID23361835
Molecular FormulaC11H10N2O2S
Molecular Weight234.28 g/mol
Exact Mass234.05
IUPAC Namephenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate
SMILESCc1cc(NC(=O)Oc2ccccc2)sn1
InChIInChI=1S/C11H10N2O2S/c1-8-7-10(16-13-8)12-11(14)15-9-5-3-2-4-6-9/h2-7H,1H3,(H,12,14)
InChIKeyNDRJEJCOCPGDDA-UHFFFAOYSA-N
XLogP3.06
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

phenyl N-(5-methyl-1,2-oxazol-3-yl)carbamate
CID 4519264
phenyl N-(2-tert-butyl-6-methyl-4-pyridinyl)carbamate
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phenyl N-(3-tert-butyl-1,2,4-thiadiazol-5-yl)carbamate
CID 162365120
5-(phenoxycarbonylamino)-1,2,4-thiadiazole-3-carboxylic acid
CID 175751128
ethyl 3-methyl-5-(phenoxycarbonylamino)-1,2-thiazole-4-carboxylate
CID 2820507
(E)-2,3-dichloro-4-[(3-methyl-1,2-thiazol-5-yl)amino]-4-oxobut-2-enoic acid
CID 134108991
5-methyl-2-(phenoxycarbonylamino)thiophene-3-carboxylic acid
CID 63617001
phenyl N-(methylamino)carbamate
CID 59676988
phenyl N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)carbamate
CID 108727693
4-methyl-1,3-thiazol-2-amine;phenyl N-(4-methyl-1,3-thiazol-2-yl)carbamate
CID 157237511
4-methyl-5-(phenoxycarbonylamino)phthalic acid
CID 67543732
phenyl N-(2-bromo-4-methylphenyl)carbamate
CID 3453949

Frequently Asked Questions

What is the IUPAC name of phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate?
The IUPAC name of phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate (CID 23361835) is phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate.
What is the SMILES notation for phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate?
The canonical SMILES for phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate is Cc1cc(NC(=O)Oc2ccccc2)sn1.
What is the InChIKey of phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate?
The InChIKey is NDRJEJCOCPGDDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2S/c1-8-7-10(16-13-8)12-11(14)15-9-5-3-2-4-6-9/h2-7H,1H3,(H,12,14).
What are the key properties of phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate?
phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate has a molecular weight of 234.28 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(3-methyl-1,2-thiazol-5-yl)carbamate is sourced from PubChem (CID 23361835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).