[2-(4-methoxyanilino)-2-oxoethyl]carbamic acid

C10H12N2O4 — CID 67025275

IUPAC[2-(4-methoxyanilino)-2-oxoethyl]carbamic acid
SMILESCOc1ccc(NC(=O)CNC(=O)O)cc1
InChIInChI=1S/C10H12N2O4/c1-16-8-4-2-7(3-5-8)12-9(13)6-11-10(14)15/h2-5,11H,6H2,1H3,(H,12,13)(H,14,15)
InChIKeyOAMIGWOCWVEZBT-UHFFFAOYSA-N
MW224.22 g/mol
LogP0.90
Rot. Bonds4

About [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid

[2-(4-methoxyanilino)-2-oxoethyl]carbamic acid (PubChem CID 67025275) has the molecular formula C10H12N2O4 and a molecular weight of 224.22 g/mol. Its IUPAC name is [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid.

Molecular Properties

Compound Name[2-(4-methoxyanilino)-2-oxoethyl]carbamic acid
PubChem CID67025275
Molecular FormulaC10H12N2O4
Molecular Weight224.22 g/mol
Exact Mass224.08
IUPAC Name[2-(4-methoxyanilino)-2-oxoethyl]carbamic acid
SMILESCOc1ccc(NC(=O)CNC(=O)O)cc1
InChIInChI=1S/C10H12N2O4/c1-16-8-4-2-7(3-5-8)12-9(13)6-11-10(14)15/h2-5,11H,6H2,1H3,(H,12,13)(H,14,15)
InChIKeyOAMIGWOCWVEZBT-UHFFFAOYSA-N
XLogP0.90
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 112998708
N-[2-(4-methoxyanilino)-2-oxoethyl]-2,2-dimethylpropanamide
CID 771979
2-(4-methoxyanilino)-N-phenylacetamide
CID 7636829
2-(ethylamino)-N-(4-methoxyphenyl)acetamide
CID 2113294
N'-(4-methoxyphenyl)-N-phenylpropanediamide
CID 15154641
2-(4-hydroxyphenyl)-N-[2-(4-methoxyanilino)-2-oxoethyl]acetamide
CID 122191191
2-(4-methoxyanilino)-N-[2-(4-methoxyanilino)-2-oxoethyl]-2-methylpropanamide
CID 134917893
benzyl N-[2-(4-methoxyanilino)-2-oxoethyl]carbamate
CID 60596184
2-(tert-butylamino)-N-(4-methoxyphenyl)acetamide
CID 27149891
N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide
CID 5172800
2-[(3,4-dimethylphenyl)carbamoylamino]-N-(4-methoxyphenyl)acetamide
CID 42766024
cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium
CID 7297720

Frequently Asked Questions

What is the IUPAC name of [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid?
The IUPAC name of [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid (CID 67025275) is [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid.
What is the SMILES notation for [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid?
The canonical SMILES for [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid is COc1ccc(NC(=O)CNC(=O)O)cc1.
What is the InChIKey of [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid?
The InChIKey is OAMIGWOCWVEZBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O4/c1-16-8-4-2-7(3-5-8)12-9(13)6-11-10(14)15/h2-5,11H,6H2,1H3,(H,12,13)(H,14,15).
What are the key properties of [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid?
[2-(4-methoxyanilino)-2-oxoethyl]carbamic acid has a molecular weight of 224.22 g/mol, XLogP of 0.90, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methoxyanilino)-2-oxoethyl]carbamic acid is sourced from PubChem (CID 67025275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).