1-phenoxy-3-prop-2-enylurea

C10H12N2O2 — CID 119090624

IUPAC1-phenoxy-3-prop-2-enylurea
SMILESC=CCNC(=O)NOc1ccccc1
InChIInChI=1S/C10H12N2O2/c1-2-8-11-10(13)12-14-9-6-4-3-5-7-9/h2-7H,1,8H2,(H2,11,12,13)
InChIKeyMAOSHVZIABCFML-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.47
Rot. Bonds4

About 1-phenoxy-3-prop-2-enylurea

1-phenoxy-3-prop-2-enylurea (PubChem CID 119090624) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 1-phenoxy-3-prop-2-enylurea.

Molecular Properties

Compound Name1-phenoxy-3-prop-2-enylurea
PubChem CID119090624
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name1-phenoxy-3-prop-2-enylurea
SMILESC=CCNC(=O)NOc1ccccc1
InChIInChI=1S/C10H12N2O2/c1-2-8-11-10(13)12-14-9-6-4-3-5-7-9/h2-7H,1,8H2,(H2,11,12,13)
InChIKeyMAOSHVZIABCFML-UHFFFAOYSA-N
XLogP1.47
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(phenoxymethyl)-3-prop-2-enylurea
CID 108888930
1-(4-phenylphenyl)-3-prop-2-enylurea
CID 23990496
N-[2-oxo-2-(prop-2-enylamino)ethyl]-3-phenoxypropanamide
CID 112990545
2-[(2-phenoxyacetyl)amino]-N-prop-2-enylacetamide
CID 2094904
1-(6-phenoxy-3-pyridinyl)-3-prop-2-enylurea
CID 42878418
methyl 3-phenyl-2-(prop-2-enylcarbamoylamino)propanoate
CID 4255047
[2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 2-[(4-phenoxybenzoyl)amino]acetate
CID 7833340
2-(phenoxymethyl)-N-prop-2-enylbenzamide
CID 9399802
naphthalen-2-yl N-prop-2-enylcarbamate
CID 71396312
1-phenylethyl N-prop-2-enylcarbamate
CID 67912904
2-(3-aminophenoxy)-N-(prop-2-enylcarbamoyl)acetamide
CID 54908616
2-(2-phenoxyanilino)-N-prop-2-enylacetamide
CID 108992999

Frequently Asked Questions

What is the IUPAC name of 1-phenoxy-3-prop-2-enylurea?
The IUPAC name of 1-phenoxy-3-prop-2-enylurea (CID 119090624) is 1-phenoxy-3-prop-2-enylurea.
What is the SMILES notation for 1-phenoxy-3-prop-2-enylurea?
The canonical SMILES for 1-phenoxy-3-prop-2-enylurea is C=CCNC(=O)NOc1ccccc1.
What is the InChIKey of 1-phenoxy-3-prop-2-enylurea?
The InChIKey is MAOSHVZIABCFML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-2-8-11-10(13)12-14-9-6-4-3-5-7-9/h2-7H,1,8H2,(H2,11,12,13).
What are the key properties of 1-phenoxy-3-prop-2-enylurea?
1-phenoxy-3-prop-2-enylurea has a molecular weight of 192.22 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenoxy-3-prop-2-enylurea is sourced from PubChem (CID 119090624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).