[2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate

C15H20N2O4 — CID 24836202

IUPAC[2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate
SMILESC=CCc1cccc(OC(=O)N(C)C)c1OC(=O)N(C)C
InChIInChI=1S/C15H20N2O4/c1-6-8-11-9-7-10-12(20-14(18)16(2)3)13(11)21-15(19)17(4)5/h6-7,9-10H,1,8H2,2-5H3
InChIKeyVDRUCRBMBMTCDO-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.54
Rot. Bonds4

About [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate

[2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate (PubChem CID 24836202) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate.

Molecular Properties

Compound Name[2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate
PubChem CID24836202
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name[2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate
SMILESC=CCc1cccc(OC(=O)N(C)C)c1OC(=O)N(C)C
InChIInChI=1S/C15H20N2O4/c1-6-8-11-9-7-10-12(20-14(18)16(2)3)13(11)21-15(19)17(4)5/h6-7,9-10H,1,8H2,2-5H3
InChIKeyVDRUCRBMBMTCDO-UHFFFAOYSA-N
XLogP2.54
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate 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

[2,6-bis(prop-2-enyl)phenyl] N,N-dimethylcarbamate
CID 518063
[2-(dimethylcarbamoyloxy)-3-propylphenyl] N,N-dimethylcarbamate
CID 24836204
[2-(2-methylphenoxy)-6-prop-2-enylphenyl] acetate
CID 13066658
(2-prop-2-enylphenyl) acetate;dihydrobromide
CID 70043796
[2-(dimethylcarbamoyloxy)-3-[(trimethylazaniumyl)methyl]phenyl]methyl-trimethylazanium
CID 135121841
acetic acid;2-methoxy-3-prop-2-enylphenol
CID 174703857
(2-prop-2-enylphenyl) 2-oxoacetate
CID 87234163
[2-[[16-[[2-(dimethylcarbamoyloxy)phenyl]methyl-ethylamino]hexadecyl-ethylamino]methyl]phenyl] N,N-dimethylcarbamate
CID 57129302
carbonic acid;formaldehyde;1-prop-2-enylnaphthalene
CID 175360952
1-(2-prop-2-enylphenoxy)pentan-2-one
CID 62044058
methyl 4-[4-[4-methoxy-4-oxo-3-(2-prop-2-enylphenoxy)butyl]phenyl]-2-(2-prop-2-enylphenoxy)butanoate
CID 22954472
bromomethane;[2-[[10-[[2-(dimethylcarbamoyloxy)phenyl]methyl-ethylamino]decyl-ethylamino]methyl]phenyl] N,N-dimethylcarbamate
CID 70405503

Frequently Asked Questions

What is the IUPAC name of [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate?
The IUPAC name of [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate (CID 24836202) is [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate.
What is the SMILES notation for [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate?
The canonical SMILES for [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate is C=CCc1cccc(OC(=O)N(C)C)c1OC(=O)N(C)C.
What is the InChIKey of [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate?
The InChIKey is VDRUCRBMBMTCDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-6-8-11-9-7-10-12(20-14(18)16(2)3)13(11)21-15(19)17(4)5/h6-7,9-10H,1,8H2,2-5H3.
What are the key properties of [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate?
[2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate has a molecular weight of 292.34 g/mol, XLogP of 2.54, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(dimethylcarbamoyloxy)-3-prop-2-enylphenyl] N,N-dimethylcarbamate is sourced from PubChem (CID 24836202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).