methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate

C11H14N2O3 — CID 112996292

IUPACmethyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate
SMILESCOC(=O)NCC(=O)N(C)c1ccccc1
InChIInChI=1S/C11H14N2O3/c1-13(9-6-4-3-5-7-9)10(14)8-12-11(15)16-2/h3-7H,8H2,1-2H3,(H,12,15)
InChIKeyBCVAZTPEJMFACM-UHFFFAOYSA-N
MW222.24 g/mol
LogP1.01
Rot. Bonds3

About methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate

methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate (PubChem CID 112996292) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate.

Molecular Properties

Compound Namemethyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate
PubChem CID112996292
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Namemethyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate
SMILESCOC(=O)NCC(=O)N(C)c1ccccc1
InChIInChI=1S/C11H14N2O3/c1-13(9-6-4-3-5-7-9)10(14)8-12-11(15)16-2/h3-7H,8H2,1-2H3,(H,12,15)
InChIKeyBCVAZTPEJMFACM-UHFFFAOYSA-N
XLogP1.01
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(N-methylanilino)-2-oxoethyl]benzamide
CID 12674158
N-[2-(N-methylanilino)-2-oxoethyl]-2,2-diphenylacetamide
CID 112996260
N-[2-(N-methylanilino)-2-oxoethyl]-3-phenylpropanamide
CID 112996270
tert-butyl N-[2-(4-methoxy-N-methylanilino)-2-oxoethyl]carbamate
CID 118576936
2-(cyclopropylmethylamino)-N-methyl-N-phenylacetamide
CID 60842442
N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide
CID 54838219
tert-butyl N-[2-[N-(dimethylcarbamoyl)anilino]-2-oxoethyl]carbamate
CID 69441199
N-methyl-N-phenyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914951
3-amino-N-methyl-N-phenyl-3-sulfanylidenepropanamide
CID 28942333
[2-[methyl(pyridin-3-yl)amino]-2-oxoethyl]carbamic acid
CID 174507293
2-(2,6-dichloroanilino)-N-methyl-N-phenylacetamide
CID 109007260
3-hydroxy-N-methyl-N-phenylpropanamide
CID 82111467

Frequently Asked Questions

What is the IUPAC name of methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate?
The IUPAC name of methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate (CID 112996292) is methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate.
What is the SMILES notation for methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate?
The canonical SMILES for methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate is COC(=O)NCC(=O)N(C)c1ccccc1.
What is the InChIKey of methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate?
The InChIKey is BCVAZTPEJMFACM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-13(9-6-4-3-5-7-9)10(14)8-12-11(15)16-2/h3-7H,8H2,1-2H3,(H,12,15).
What are the key properties of methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate?
methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate has a molecular weight of 222.24 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[2-(N-methylanilino)-2-oxoethyl]carbamate is sourced from PubChem (CID 112996292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).