ethyl N-(2-methoxy-5-methylphenyl)carbamate

C11H15NO3 — CID 731635

IUPACethyl N-(2-methoxy-5-methylphenyl)carbamate
SMILESCCOC(=O)Nc1cc(C)ccc1OC
InChIInChI=1S/C11H15NO3/c1-4-15-11(13)12-9-7-8(2)5-6-10(9)14-3/h5-7H,4H2,1-3H3,(H,12,13)
InChIKeyQDJJDRMGIIKSMK-UHFFFAOYSA-N
MW209.24 g/mol
LogP2.57
Rot. Bonds3

About ethyl N-(2-methoxy-5-methylphenyl)carbamate

ethyl N-(2-methoxy-5-methylphenyl)carbamate (PubChem CID 731635) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is ethyl N-(2-methoxy-5-methylphenyl)carbamate.

Molecular Properties

Compound Nameethyl N-(2-methoxy-5-methylphenyl)carbamate
PubChem CID731635
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Nameethyl N-(2-methoxy-5-methylphenyl)carbamate
SMILESCCOC(=O)Nc1cc(C)ccc1OC
InChIInChI=1S/C11H15NO3/c1-4-15-11(13)12-9-7-8(2)5-6-10(9)14-3/h5-7H,4H2,1-3H3,(H,12,13)
InChIKeyQDJJDRMGIIKSMK-UHFFFAOYSA-N
XLogP2.57
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methoxy-5-Methylaniline
CID 8445
Acetamide, N-(2-methoxyphenyl)-
CID 7135
Acetamide, N-(2-methoxy-5-methylphenyl)-
CID 81412
5-Methyl-2,3-dihydro-1,3-benzoxazol-2-one
CID 322632
(3-Aminophenyl) N-(3-methylphenyl)carbamate
CID 139597871
N-[2-(Benzyloxy)phenyl]acetamide
CID 4683060
2-(Dimethylamino)ethyl N-(2-methoxyphenyl)carbamate
CID 50033
2-Methoxyformanilide
CID 243581
6-methyl-1,3-benzoxazol-2(3H)-one
CID 322634
5-Methyl-1,3-benzoxazole-2(3H)-thione
CID 710258
2H-1,4-Benzoxazine-3(4H)-one, 6-methyl-
CID 2763839
Methyl N-(2-methoxyphenyl)carbamate
CID 602319

Frequently Asked Questions

What is the IUPAC name of ethyl N-(2-methoxy-5-methylphenyl)carbamate?
The IUPAC name of ethyl N-(2-methoxy-5-methylphenyl)carbamate (CID 731635) is ethyl N-(2-methoxy-5-methylphenyl)carbamate.
What is the SMILES notation for ethyl N-(2-methoxy-5-methylphenyl)carbamate?
The canonical SMILES for ethyl N-(2-methoxy-5-methylphenyl)carbamate is CCOC(=O)Nc1cc(C)ccc1OC.
What is the InChIKey of ethyl N-(2-methoxy-5-methylphenyl)carbamate?
The InChIKey is QDJJDRMGIIKSMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-4-15-11(13)12-9-7-8(2)5-6-10(9)14-3/h5-7H,4H2,1-3H3,(H,12,13).
What are the key properties of ethyl N-(2-methoxy-5-methylphenyl)carbamate?
ethyl N-(2-methoxy-5-methylphenyl)carbamate has a molecular weight of 209.24 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2-methoxy-5-methylphenyl)carbamate is sourced from PubChem (CID 731635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).