2-(2,4-dimethylphenyl)ethyl carbamate

C11H15NO2 — CID 123427544

IUPAC2-(2,4-dimethylphenyl)ethyl carbamate
SMILESCc1ccc(CCOC(N)=O)c(C)c1
InChIInChI=1S/C11H15NO2/c1-8-3-4-10(9(2)7-8)5-6-14-11(12)13/h3-4,7H,5-6H2,1-2H3,(H2,12,13)
InChIKeyUCBVYCQSIVGAAQ-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.94
Rot. Bonds3

About 2-(2,4-dimethylphenyl)ethyl carbamate

2-(2,4-dimethylphenyl)ethyl carbamate (PubChem CID 123427544) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)ethyl carbamate.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)ethyl carbamate
PubChem CID123427544
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-(2,4-dimethylphenyl)ethyl carbamate
SMILESCc1ccc(CCOC(N)=O)c(C)c1
InChIInChI=1S/C11H15NO2/c1-8-3-4-10(9(2)7-8)5-6-14-11(12)13/h3-4,7H,5-6H2,1-2H3,(H2,12,13)
InChIKeyUCBVYCQSIVGAAQ-UHFFFAOYSA-N
XLogP1.94
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2,4-dimethylphenyl)ethyl 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

4-(2,4-dimethylphenyl)-2-oxobutanoic acid
CID 57302764
3-(2,4-dimethylphenyl)propanoic acid
CID 3870217
1-amino-4-(2,4-dimethylphenyl)butan-2-one
CID 82281462
3-(2,4-dimethylphenyl)propanehydrazide
CID 116843444
2-propan-2-yloxyethyl 3-(2,4-dimethylphenyl)propanoate
CID 78832911
2-[(2,5-dimethylphenyl)methylamino]ethyl carbamate
CID 83210925
methyl N-[2-(2,4-dimethylphenyl)ethyl]carbamate
CID 110787753
2-O-[2-(2,5-dimethylphenyl)ethyl] 1-O-ethyl oxalate
CID 91658040
6-(2,4-dimethylphenyl)-2-methylhexan-3-one
CID 83928031
2-(2,4-dimethylphenyl)ethyl-methylcarbamic acid
CID 115171227
(2,4-dimethylphenyl)methyl 2-aminoacetate
CID 82112007
2-bromo-N-[2-(2,4-dimethylphenyl)ethyl]acetamide
CID 82109034

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)ethyl carbamate?
The IUPAC name of 2-(2,4-dimethylphenyl)ethyl carbamate (CID 123427544) is 2-(2,4-dimethylphenyl)ethyl carbamate.
What is the SMILES notation for 2-(2,4-dimethylphenyl)ethyl carbamate?
The canonical SMILES for 2-(2,4-dimethylphenyl)ethyl carbamate is Cc1ccc(CCOC(N)=O)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)ethyl carbamate?
The InChIKey is UCBVYCQSIVGAAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8-3-4-10(9(2)7-8)5-6-14-11(12)13/h3-4,7H,5-6H2,1-2H3,(H2,12,13).
What are the key properties of 2-(2,4-dimethylphenyl)ethyl carbamate?
2-(2,4-dimethylphenyl)ethyl carbamate has a molecular weight of 193.25 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)ethyl carbamate is sourced from PubChem (CID 123427544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).