1-(3-ethoxyphenyl)-1-ethylurea

C11H16N2O2 — CID 3032085

IUPAC1-(3-ethoxyphenyl)-1-ethylurea
SMILESCCOc1cccc(N(CC)C(N)=O)c1
InChIInChI=1S/C11H16N2O2/c1-3-13(11(12)14)9-6-5-7-10(8-9)15-4-2/h5-8H,3-4H2,1-2H3,(H2,12,14)
InChIKeyYZGHKIVQDWBQBJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.99
Rot. Bonds4

About 1-(3-ethoxyphenyl)-1-ethylurea

1-(3-ethoxyphenyl)-1-ethylurea (PubChem CID 3032085) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(3-ethoxyphenyl)-1-ethylurea.

Molecular Properties

Compound Name1-(3-ethoxyphenyl)-1-ethylurea
PubChem CID3032085
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name1-(3-ethoxyphenyl)-1-ethylurea
SMILESCCOc1cccc(N(CC)C(N)=O)c1
InChIInChI=1S/C11H16N2O2/c1-3-13(11(12)14)9-6-5-7-10(8-9)15-4-2/h5-8H,3-4H2,1-2H3,(H2,12,14)
InChIKeyYZGHKIVQDWBQBJ-UHFFFAOYSA-N
XLogP1.99
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 3032093
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2-(3-ethoxy-N-methylsulfonylanilino)-N,N-diethylacetamide
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1-(2-hydroxyethyl)-1-(3-methoxyphenyl)urea
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CID 61090934
2-(3-ethoxyphenoxy)-N-methylacetohydrazide
CID 116820503
ethyl 3-[3-(diethylamino)phenoxy]propanoate
CID 43517017
1-ethyl-1-(4-phenylmethoxyphenyl)urea
CID 67835509
N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide
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3-amino-5-ethoxy-N-ethyl-N-phenylbenzamide
CID 81094810

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxyphenyl)-1-ethylurea?
The IUPAC name of 1-(3-ethoxyphenyl)-1-ethylurea (CID 3032085) is 1-(3-ethoxyphenyl)-1-ethylurea.
What is the SMILES notation for 1-(3-ethoxyphenyl)-1-ethylurea?
The canonical SMILES for 1-(3-ethoxyphenyl)-1-ethylurea is CCOc1cccc(N(CC)C(N)=O)c1.
What is the InChIKey of 1-(3-ethoxyphenyl)-1-ethylurea?
The InChIKey is YZGHKIVQDWBQBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-3-13(11(12)14)9-6-5-7-10(8-9)15-4-2/h5-8H,3-4H2,1-2H3,(H2,12,14).
What are the key properties of 1-(3-ethoxyphenyl)-1-ethylurea?
1-(3-ethoxyphenyl)-1-ethylurea has a molecular weight of 208.26 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxyphenyl)-1-ethylurea is sourced from PubChem (CID 3032085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).