(2,4-dimethoxyphenyl)methyl-methylcarbamic acid

C11H15NO4 — CID 115170960

IUPAC(2,4-dimethoxyphenyl)methyl-methylcarbamic acid
SMILESCOc1ccc(CN(C)C(=O)O)c(OC)c1
InChIInChI=1S/C11H15NO4/c1-12(11(13)14)7-8-4-5-9(15-2)6-10(8)16-3/h4-6H,7H2,1-3H3,(H,13,14)
InChIKeyFNRTUJMXAPEHPH-UHFFFAOYSA-N
MW225.24 g/mol
LogP1.81
Rot. Bonds4

About (2,4-dimethoxyphenyl)methyl-methylcarbamic acid

(2,4-dimethoxyphenyl)methyl-methylcarbamic acid (PubChem CID 115170960) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is (2,4-dimethoxyphenyl)methyl-methylcarbamic acid.

Molecular Properties

Compound Name(2,4-dimethoxyphenyl)methyl-methylcarbamic acid
PubChem CID115170960
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name(2,4-dimethoxyphenyl)methyl-methylcarbamic acid
SMILESCOc1ccc(CN(C)C(=O)O)c(OC)c1
InChIInChI=1S/C11H15NO4/c1-12(11(13)14)7-8-4-5-9(15-2)6-10(8)16-3/h4-6H,7H2,1-3H3,(H,13,14)
InChIKeyFNRTUJMXAPEHPH-UHFFFAOYSA-N
XLogP1.81
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2,4-dimethoxyphenyl)methyl-methylcarbamic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2,4-dimethoxyphenyl)methyl-methylcarbamothioic S-acid
CID 115170104
N-[(2,4-dimethoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 94687468
N-[(2,4-dimethoxyphenyl)methyl]-2,4-dimethoxy-N-methylbenzamide
CID 18111734
N-[(2,4-dimethoxyphenyl)methyl]-2-hydroxy-N-methylpropanamide
CID 115140783
2-[(2,4-dimethoxyphenyl)methyl-methylamino]acetic acid
CID 60712632
N-benzyl-2-(2,4-dimethoxyphenyl)-N-methylacetamide
CID 110767880
N-[(2,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide
CID 115157957
N-[(2,4-dimethoxyphenyl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide
CID 7930585
N-[(2,4-dimethoxyphenyl)methyl]-N-methyl-3-methylsulfanylpropanamide
CID 112790479
2-(4-aminophenyl)-N-[(2,4-dimethoxyphenyl)methyl]-N-methylacetamide
CID 119682696
N-[(2,4-dimethoxyphenyl)methyl]-N-methyl-4-(methylamino)butanamide
CID 119682698
2-cyano-N-[(2,4-dimethoxyphenyl)methyl]-N,2-dimethylpropanamide
CID 47230621

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethoxyphenyl)methyl-methylcarbamic acid?
The IUPAC name of (2,4-dimethoxyphenyl)methyl-methylcarbamic acid (CID 115170960) is (2,4-dimethoxyphenyl)methyl-methylcarbamic acid.
What is the SMILES notation for (2,4-dimethoxyphenyl)methyl-methylcarbamic acid?
The canonical SMILES for (2,4-dimethoxyphenyl)methyl-methylcarbamic acid is COc1ccc(CN(C)C(=O)O)c(OC)c1.
What is the InChIKey of (2,4-dimethoxyphenyl)methyl-methylcarbamic acid?
The InChIKey is FNRTUJMXAPEHPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-12(11(13)14)7-8-4-5-9(15-2)6-10(8)16-3/h4-6H,7H2,1-3H3,(H,13,14).
What are the key properties of (2,4-dimethoxyphenyl)methyl-methylcarbamic acid?
(2,4-dimethoxyphenyl)methyl-methylcarbamic acid has a molecular weight of 225.24 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethoxyphenyl)methyl-methylcarbamic acid is sourced from PubChem (CID 115170960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).