N-(2,5-dimethylphenyl)-N-ethylcarbamate

C11H14NO2- — CID 57353487

IUPACN-(2,5-dimethylphenyl)-N-ethylcarbamate
SMILESCCN(C(=O)[O-])c1cc(C)ccc1C
InChIInChI=1S/C11H15NO2/c1-4-12(11(13)14)10-7-8(2)5-6-9(10)3/h5-7H,4H2,1-3H3,(H,13,14)/p-1
InChIKeyYBNLWBYKVLVFOE-UHFFFAOYSA-M
MW192.24 g/mol
LogP1.47
Rot. Bonds2

About N-(2,5-dimethylphenyl)-N-ethylcarbamate

N-(2,5-dimethylphenyl)-N-ethylcarbamate (PubChem CID 57353487) has the molecular formula C11H14NO2- and a molecular weight of 192.24 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-N-ethylcarbamate.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-N-ethylcarbamate
PubChem CID57353487
Molecular FormulaC11H14NO2-
Molecular Weight192.24 g/mol
Exact Mass192.10
IUPAC NameN-(2,5-dimethylphenyl)-N-ethylcarbamate
SMILESCCN(C(=O)[O-])c1cc(C)ccc1C
InChIInChI=1S/C11H15NO2/c1-4-12(11(13)14)10-7-8(2)5-6-9(10)3/h5-7H,4H2,1-3H3,(H,13,14)/p-1
InChIKeyYBNLWBYKVLVFOE-UHFFFAOYSA-M
XLogP1.47
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chloro-2-methylphenyl)-N-ethylcarbamate
CID 57352737
N-(2,5-dimethylphenyl)-N-ethyl-4-methylpentanamide
CID 78853870
N-(2,5-dimethylphenyl)-N-ethyl-3,5-difluorobenzamide
CID 52574596
2-chloro-N-(2,4-dimethylphenyl)-N-ethylacetamide
CID 131561562
N-[3-[carboxylato(pentyl)amino]-4-methylphenyl]-N-pentylcarbamate
CID 57360084
3-(N-acetyl-2,5-dimethylanilino)-N,N-diethylpropanamide
CID 113124355
N-(2,5-dimethylphenyl)-N-ethyl-2,6-dimethylquinoline-4-carboxamide
CID 55591955
N,N-diethyl-2,5-dimethylbenzamide
CID 15621070
3-(N-ethyl-2,5-dimethylanilino)propan-1-ol
CID 110935894
N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide
CID 94622687
N-(2,4-dimethylphenyl)-N-ethyl-2-methylpropanamide
CID 78853766
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-methylbenzamide
CID 107733112

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-N-ethylcarbamate?
The IUPAC name of N-(2,5-dimethylphenyl)-N-ethylcarbamate (CID 57353487) is N-(2,5-dimethylphenyl)-N-ethylcarbamate.
What is the SMILES notation for N-(2,5-dimethylphenyl)-N-ethylcarbamate?
The canonical SMILES for N-(2,5-dimethylphenyl)-N-ethylcarbamate is CCN(C(=O)[O-])c1cc(C)ccc1C.
What is the InChIKey of N-(2,5-dimethylphenyl)-N-ethylcarbamate?
The InChIKey is YBNLWBYKVLVFOE-UHFFFAOYSA-M. The full InChI is InChI=1S/C11H15NO2/c1-4-12(11(13)14)10-7-8(2)5-6-9(10)3/h5-7H,4H2,1-3H3,(H,13,14)/p-1.
What are the key properties of N-(2,5-dimethylphenyl)-N-ethylcarbamate?
N-(2,5-dimethylphenyl)-N-ethylcarbamate has a molecular weight of 192.24 g/mol, XLogP of 1.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-N-ethylcarbamate is sourced from PubChem (CID 57353487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).