methyl N-(4-acetylphenyl)-N-methylcarbamate

C11H13NO3 — CID 132820157

IUPACmethyl N-(4-acetylphenyl)-N-methylcarbamate
SMILESCOC(=O)N(C)c1ccc(C(C)=O)cc1
InChIInChI=1S/C11H13NO3/c1-8(13)9-4-6-10(7-5-9)12(2)11(14)15-3/h4-7H,1-3H3
InChIKeyAVUNGZSQLSQEFD-UHFFFAOYSA-N
MW207.23 g/mol
LogP2.09
Rot. Bonds2

About methyl N-(4-acetylphenyl)-N-methylcarbamate

methyl N-(4-acetylphenyl)-N-methylcarbamate (PubChem CID 132820157) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is methyl N-(4-acetylphenyl)-N-methylcarbamate.

Molecular Properties

Compound Namemethyl N-(4-acetylphenyl)-N-methylcarbamate
PubChem CID132820157
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Namemethyl N-(4-acetylphenyl)-N-methylcarbamate
SMILESCOC(=O)N(C)c1ccc(C(C)=O)cc1
InChIInChI=1S/C11H13NO3/c1-8(13)9-4-6-10(7-5-9)12(2)11(14)15-3/h4-7H,1-3H3
InChIKeyAVUNGZSQLSQEFD-UHFFFAOYSA-N
XLogP2.09
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

methyl N-(4-carbamothioylphenyl)-N-methylcarbamate
CID 62971383
methyl N-methyl-N-(4-methylsulfonylphenyl)carbamate
CID 5082622
1-[4-(hydroxyamino)phenyl]ethanone;methane;methyl N-(4-acetylphenyl)-N-hydroxycarbamate
CID 158646548
1-[4-[4-(dimethylamino)anilino]phenyl]ethanone
CID 82536662
1-(4-acetylphenyl)ethanone;methane
CID 159515104
methyl N-(6-amino-3-pyridinyl)-N-methylcarbamate
CID 115268442
methyl 4-[methyl(2-methylprop-2-enoyl)amino]benzoate
CID 25138779
methyl N-(3-bromo-4-methoxyphenyl)-N-methylcarbamate
CID 115190454
4-(N-methylanilino)benzoic acid;1-[4-(N-methylanilino)phenyl]ethanone
CID 159806188
methyl 4-(4-methoxycarbonyl-N-methylanilino)benzoate
CID 11335546
methyl N-(3-carbamothioylphenyl)-N-methylcarbamate
CID 62969639
1-[4-(dimethylamino)phenyl]ethanone;pentan-3-one
CID 161487029

Frequently Asked Questions

What is the IUPAC name of methyl N-(4-acetylphenyl)-N-methylcarbamate?
The IUPAC name of methyl N-(4-acetylphenyl)-N-methylcarbamate (CID 132820157) is methyl N-(4-acetylphenyl)-N-methylcarbamate.
What is the SMILES notation for methyl N-(4-acetylphenyl)-N-methylcarbamate?
The canonical SMILES for methyl N-(4-acetylphenyl)-N-methylcarbamate is COC(=O)N(C)c1ccc(C(C)=O)cc1.
What is the InChIKey of methyl N-(4-acetylphenyl)-N-methylcarbamate?
The InChIKey is AVUNGZSQLSQEFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-8(13)9-4-6-10(7-5-9)12(2)11(14)15-3/h4-7H,1-3H3.
What are the key properties of methyl N-(4-acetylphenyl)-N-methylcarbamate?
methyl N-(4-acetylphenyl)-N-methylcarbamate has a molecular weight of 207.23 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(4-acetylphenyl)-N-methylcarbamate is sourced from PubChem (CID 132820157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).