(2-methoxyphenyl) N-propan-2-ylcarbamate

C11H15NO3 — CID 2802349

IUPAC(2-methoxyphenyl) N-propan-2-ylcarbamate
SMILESCOc1ccccc1OC(=O)NC(C)C
InChIInChI=1S/C11H15NO3/c1-8(2)12-11(13)15-10-7-5-4-6-9(10)14-3/h4-8H,1-3H3,(H,12,13)
InChIKeyAERMGQIDPOIRKP-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.19
Rot. Bonds3

About (2-methoxyphenyl) N-propan-2-ylcarbamate

(2-methoxyphenyl) N-propan-2-ylcarbamate (PubChem CID 2802349) has the molecular formula C11H15NO3 and a molecular weight of 209.25 g/mol. Its IUPAC name is (2-methoxyphenyl) N-propan-2-ylcarbamate.

Molecular Properties

Compound Name(2-methoxyphenyl) N-propan-2-ylcarbamate
PubChem CID2802349
Molecular FormulaC11H15NO3
Molecular Weight209.25 g/mol
Exact Mass209.11
IUPAC Name(2-methoxyphenyl) N-propan-2-ylcarbamate
SMILESCOc1ccccc1OC(=O)NC(C)C
InChIInChI=1S/C11H15NO3/c1-8(2)12-11(13)15-10-7-5-4-6-9(10)14-3/h4-8H,1-3H3,(H,12,13)
InChIKeyAERMGQIDPOIRKP-UHFFFAOYSA-N
XLogP2.19
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-methoxyphenyl) N-propan-2-ylcarbamate 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-prop-1-en-2-ylphenyl) N-propan-2-ylcarbamate
CID 175099692
(2-nitrophenyl) N-propan-2-ylcarbamate
CID 11241573
(2-methoxyphenyl) 2-methylpropanoate
CID 836904
3-O-(2-methoxyphenyl) 1-O-methyl 2-methylpropanedioate
CID 57097256
[2-(2-phenylethynyl)phenyl] N-propan-2-ylcarbamate
CID 11507410
1-(2-methoxyphenyl)-3-propan-2-ylurea
CID 19167870
3-(2-methoxyphenoxy)-2-oxo-N-propan-2-ylbutanamide
CID 139329282
2-chloro-2-(2-methoxyphenyl)-N-propan-2-ylacetamide
CID 62224229
2-hydroxy-3-(2-methoxyphenoxy)-N-propan-2-ylbutanamide
CID 134349437
(2-methoxyphenyl) 2-methoxyacetate
CID 53423767
(1-bromonaphthalen-2-yl) N-propan-2-ylcarbamate
CID 70693146
(2-methylphenyl) N-(1-hydroxyethyl)carbamate
CID 175546454

Frequently Asked Questions

What is the IUPAC name of (2-methoxyphenyl) N-propan-2-ylcarbamate?
The IUPAC name of (2-methoxyphenyl) N-propan-2-ylcarbamate (CID 2802349) is (2-methoxyphenyl) N-propan-2-ylcarbamate.
What is the SMILES notation for (2-methoxyphenyl) N-propan-2-ylcarbamate?
The canonical SMILES for (2-methoxyphenyl) N-propan-2-ylcarbamate is COc1ccccc1OC(=O)NC(C)C.
What is the InChIKey of (2-methoxyphenyl) N-propan-2-ylcarbamate?
The InChIKey is AERMGQIDPOIRKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-8(2)12-11(13)15-10-7-5-4-6-9(10)14-3/h4-8H,1-3H3,(H,12,13).
What are the key properties of (2-methoxyphenyl) N-propan-2-ylcarbamate?
(2-methoxyphenyl) N-propan-2-ylcarbamate has a molecular weight of 209.25 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyphenyl) N-propan-2-ylcarbamate is sourced from PubChem (CID 2802349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).