methyl N-(2-propoxyphenyl)carbamate

C11H15NO3 — CID 19872099

IUPACmethyl N-(2-propoxyphenyl)carbamate
SMILESCCCOc1ccccc1NC(=O)OC
InChIInChI=1S/C11H15NO3/c1-3-8-15-10-7-5-4-6-9(10)12-11(13)14-2/h4-7H,3,8H2,1-2H3,(H,12,13)
InChIKeyXJOOPLYRYCXISR-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.65
Rot. Bonds4

About methyl N-(2-propoxyphenyl)carbamate

methyl N-(2-propoxyphenyl)carbamate (PubChem CID 19872099) has the molecular formula C11H15NO3 and a molecular weight of 209.25 g/mol. Its IUPAC name is methyl N-(2-propoxyphenyl)carbamate.

Molecular Properties

Compound Namemethyl N-(2-propoxyphenyl)carbamate
PubChem CID19872099
Molecular FormulaC11H15NO3
Molecular Weight209.25 g/mol
Exact Mass209.11
IUPAC Namemethyl N-(2-propoxyphenyl)carbamate
SMILESCCCOc1ccccc1NC(=O)OC
InChIInChI=1S/C11H15NO3/c1-3-8-15-10-7-5-4-6-9(10)12-11(13)14-2/h4-7H,3,8H2,1-2H3,(H,12,13)
InChIKeyXJOOPLYRYCXISR-UHFFFAOYSA-N
XLogP2.65
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-2-methyl-N-(2-propoxyphenyl)propanamide
CID 114327800
2-(2-methoxyethoxy)-N-(2-propoxyphenyl)acetamide
CID 103606695
2-amino-2-methyl-N-(2-propoxyphenyl)propanamide
CID 61265402
3-amino-N-(2-propoxyphenyl)propanamide;hydrochloride
CID 119268305
2-methylsulfanyl-N-(2-propoxyphenyl)acetamide
CID 112793569
1,3-bis(2-butoxyphenyl)urea
CID 17170447
1-naphthalen-1-yl-3-(2-propoxyphenyl)urea
CID 2067216
2-anilino-N-(2-propoxyphenyl)acetamide
CID 51286142
5-chloro-N-(2-propoxyphenyl)pentanamide
CID 43697480
2-amino-N-(2-propoxyphenyl)pentanamide
CID 43702443
N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide
CID 163646977
2,5-dimethyl-N-(2-propoxyphenyl)benzamide
CID 78772580

Frequently Asked Questions

What is the IUPAC name of methyl N-(2-propoxyphenyl)carbamate?
The IUPAC name of methyl N-(2-propoxyphenyl)carbamate (CID 19872099) is methyl N-(2-propoxyphenyl)carbamate.
What is the SMILES notation for methyl N-(2-propoxyphenyl)carbamate?
The canonical SMILES for methyl N-(2-propoxyphenyl)carbamate is CCCOc1ccccc1NC(=O)OC.
What is the InChIKey of methyl N-(2-propoxyphenyl)carbamate?
The InChIKey is XJOOPLYRYCXISR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-3-8-15-10-7-5-4-6-9(10)12-11(13)14-2/h4-7H,3,8H2,1-2H3,(H,12,13).
What are the key properties of methyl N-(2-propoxyphenyl)carbamate?
methyl N-(2-propoxyphenyl)carbamate has a molecular weight of 209.25 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(2-propoxyphenyl)carbamate is sourced from PubChem (CID 19872099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).