1-ethyl-3-(2-phenylethyl)urea

C11H16N2O — CID 3051652

IUPAC1-ethyl-3-(2-phenylethyl)urea
SMILESCCNC(=O)NCCc1ccccc1
InChIInChI=1S/C11H16N2O/c1-2-12-11(14)13-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H2,12,13,14)
InChIKeyPIZUZKARBBXDME-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.55
Rot. Bonds4

About 1-ethyl-3-(2-phenylethyl)urea

1-ethyl-3-(2-phenylethyl)urea (PubChem CID 3051652) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 1-ethyl-3-(2-phenylethyl)urea.

Molecular Properties

Compound Name1-ethyl-3-(2-phenylethyl)urea
PubChem CID3051652
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name1-ethyl-3-(2-phenylethyl)urea
SMILESCCNC(=O)NCCc1ccccc1
InChIInChI=1S/C11H16N2O/c1-2-12-11(14)13-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H2,12,13,14)
InChIKeyPIZUZKARBBXDME-UHFFFAOYSA-N
XLogP1.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(2-phenylethyl)urea?
The IUPAC name of 1-ethyl-3-(2-phenylethyl)urea (CID 3051652) is 1-ethyl-3-(2-phenylethyl)urea.
What is the SMILES notation for 1-ethyl-3-(2-phenylethyl)urea?
The canonical SMILES for 1-ethyl-3-(2-phenylethyl)urea is CCNC(=O)NCCc1ccccc1.
What is the InChIKey of 1-ethyl-3-(2-phenylethyl)urea?
The InChIKey is PIZUZKARBBXDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-2-12-11(14)13-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H2,12,13,14).
What are the key properties of 1-ethyl-3-(2-phenylethyl)urea?
1-ethyl-3-(2-phenylethyl)urea has a molecular weight of 192.26 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2-phenylethyl)urea is sourced from PubChem (CID 3051652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).