methyl N-(2,4,5-trimethoxyphenyl)carbamate

C11H15NO5 — CID 115190416

IUPACmethyl N-(2,4,5-trimethoxyphenyl)carbamate
SMILESCOC(=O)Nc1cc(OC)c(OC)cc1OC
InChIInChI=1S/C11H15NO5/c1-14-8-6-10(16-3)9(15-2)5-7(8)12-11(13)17-4/h5-6H,1-4H3,(H,12,13)
InChIKeySTGGFZHGCUYYJX-UHFFFAOYSA-N
MW241.24 g/mol
LogP1.89
Rot. Bonds4

About methyl N-(2,4,5-trimethoxyphenyl)carbamate

methyl N-(2,4,5-trimethoxyphenyl)carbamate (PubChem CID 115190416) has the molecular formula C11H15NO5 and a molecular weight of 241.24 g/mol. Its IUPAC name is methyl N-(2,4,5-trimethoxyphenyl)carbamate.

Molecular Properties

Compound Namemethyl N-(2,4,5-trimethoxyphenyl)carbamate
PubChem CID115190416
Molecular FormulaC11H15NO5
Molecular Weight241.24 g/mol
Exact Mass241.10
IUPAC Namemethyl N-(2,4,5-trimethoxyphenyl)carbamate
SMILESCOC(=O)Nc1cc(OC)c(OC)cc1OC
InChIInChI=1S/C11H15NO5/c1-14-8-6-10(16-3)9(15-2)5-7(8)12-11(13)17-4/h5-6H,1-4H3,(H,12,13)
InChIKeySTGGFZHGCUYYJX-UHFFFAOYSA-N
XLogP1.89
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.24
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl N-(2,4,5-trimethoxyphenyl)carbamate 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

N-(2,4,5-trimethoxyphenyl)acetamide
CID 54074808
methyl N-(5-chloro-2,4-dimethoxyphenyl)carbamate
CID 17173078
methyl N-(2-amino-4,5-dimethoxyphenyl)carbamate
CID 43551388
N-(2,4,5-trimethoxyphenyl)carbamoyl bromide
CID 115193326
methyl N-(4,5-dimethoxy-2-nitrophenyl)carbamate
CID 110459513
CID 87920580
CID 87920580
(2-acetamido-4,5-dimethoxyphenyl) acetate
CID 102408596
3-methoxy-4-(methoxycarbonylamino)benzoic acid
CID 58375560
2,4-dimethoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid
CID 45356710
N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide
CID 146415874
methyl N-[2-hydroxy-5-methoxy-4-[(2-pyridin-1-ium-1-ylacetyl)amino]phenyl]carbamate
CID 18552108
methyl N-(4-isocyanato-2-methoxyphenyl)carbamate
CID 169354298

Frequently Asked Questions

What is the IUPAC name of methyl N-(2,4,5-trimethoxyphenyl)carbamate?
The IUPAC name of methyl N-(2,4,5-trimethoxyphenyl)carbamate (CID 115190416) is methyl N-(2,4,5-trimethoxyphenyl)carbamate.
What is the SMILES notation for methyl N-(2,4,5-trimethoxyphenyl)carbamate?
The canonical SMILES for methyl N-(2,4,5-trimethoxyphenyl)carbamate is COC(=O)Nc1cc(OC)c(OC)cc1OC.
What is the InChIKey of methyl N-(2,4,5-trimethoxyphenyl)carbamate?
The InChIKey is STGGFZHGCUYYJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO5/c1-14-8-6-10(16-3)9(15-2)5-7(8)12-11(13)17-4/h5-6H,1-4H3,(H,12,13).
What are the key properties of methyl N-(2,4,5-trimethoxyphenyl)carbamate?
methyl N-(2,4,5-trimethoxyphenyl)carbamate has a molecular weight of 241.24 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(2,4,5-trimethoxyphenyl)carbamate is sourced from PubChem (CID 115190416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).