methyl N-[1-(2-methylphenyl)ethyl]carbamate

C11H15NO2 — CID 112683657

IUPACmethyl N-[1-(2-methylphenyl)ethyl]carbamate
SMILESCOC(=O)NC(C)c1ccccc1C
InChIInChI=1S/C11H15NO2/c1-8-6-4-5-7-10(8)9(2)12-11(13)14-3/h4-7,9H,1-3H3,(H,12,13)
InChIKeyGWGFSIKSAPKASC-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.41
Rot. Bonds2

About methyl N-[1-(2-methylphenyl)ethyl]carbamate

methyl N-[1-(2-methylphenyl)ethyl]carbamate (PubChem CID 112683657) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is methyl N-[1-(2-methylphenyl)ethyl]carbamate.

Molecular Properties

Compound Namemethyl N-[1-(2-methylphenyl)ethyl]carbamate
PubChem CID112683657
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Namemethyl N-[1-(2-methylphenyl)ethyl]carbamate
SMILESCOC(=O)NC(C)c1ccccc1C
InChIInChI=1S/C11H15NO2/c1-8-6-4-5-7-10(8)9(2)12-11(13)14-3/h4-7,9H,1-3H3,(H,12,13)
InChIKeyGWGFSIKSAPKASC-UHFFFAOYSA-N
XLogP2.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze methyl N-[1-(2-methylphenyl)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

2-methoxy-N-[1-(2-methylphenyl)ethyl]propanamide
CID 112685603
(2R)-2-(methoxycarbonylamino)-2-(2-methylphenyl)acetic acid
CID 67681824
2-methoxy-N-[1-(2-methylphenyl)ethyl]benzamide
CID 18111879
2-bromo-N-[(1S)-1-(2-methylphenyl)ethyl]acetamide
CID 81374930
N-[(1R)-1-(2-methylphenyl)ethyl]prop-2-enamide
CID 81374722
N-[1-(2-methylphenyl)ethyl]-3-oxobutanamide
CID 18071549
2-amino-3-methoxy-N-[1-(2-methylphenyl)ethyl]propanamide;hydrochloride
CID 120983404
N-[1-(2-methylphenyl)ethyl]-2-phenylacetamide
CID 59082083
3-amino-N-[(1S)-1-(2-methylphenyl)ethyl]propanamide
CID 81380300
N-[1-(2-methylphenyl)ethyl]but-2-enamide
CID 78906695
3,5-dimethoxy-4-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
CID 112762358
1-[1-(2-methoxy-5-methylphenyl)ethyl]-3-[1-(2-methylphenyl)ethyl]urea
CID 42928249

Frequently Asked Questions

What is the IUPAC name of methyl N-[1-(2-methylphenyl)ethyl]carbamate?
The IUPAC name of methyl N-[1-(2-methylphenyl)ethyl]carbamate (CID 112683657) is methyl N-[1-(2-methylphenyl)ethyl]carbamate.
What is the SMILES notation for methyl N-[1-(2-methylphenyl)ethyl]carbamate?
The canonical SMILES for methyl N-[1-(2-methylphenyl)ethyl]carbamate is COC(=O)NC(C)c1ccccc1C.
What is the InChIKey of methyl N-[1-(2-methylphenyl)ethyl]carbamate?
The InChIKey is GWGFSIKSAPKASC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8-6-4-5-7-10(8)9(2)12-11(13)14-3/h4-7,9H,1-3H3,(H,12,13).
What are the key properties of methyl N-[1-(2-methylphenyl)ethyl]carbamate?
methyl N-[1-(2-methylphenyl)ethyl]carbamate has a molecular weight of 193.25 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[1-(2-methylphenyl)ethyl]carbamate is sourced from PubChem (CID 112683657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).