1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea

C16H18N2O2 — CID 18977622

IUPAC1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea
SMILESCCNC(=O)Nc1cccc(-c2cccc(OC)c2)c1
InChIInChI=1S/C16H18N2O2/c1-3-17-16(19)18-14-8-4-6-12(10-14)13-7-5-9-15(11-13)20-2/h4-11H,3H2,1-2H3,(H2,17,18,19)
InChIKeyQGYPOISDBGVYSY-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.50
Rot. Bonds4

About 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea

1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea (PubChem CID 18977622) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea.

Molecular Properties

Compound Name1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea
PubChem CID18977622
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea
SMILESCCNC(=O)Nc1cccc(-c2cccc(OC)c2)c1
InChIInChI=1S/C16H18N2O2/c1-3-17-16(19)18-14-8-4-6-12(10-14)13-7-5-9-15(11-13)20-2/h4-11H,3H2,1-2H3,(H2,17,18,19)
InChIKeyQGYPOISDBGVYSY-UHFFFAOYSA-N
XLogP3.50
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(3-methoxyphenyl)carbamoylamino]ethyl]acetamide
CID 47140507
1-ethyl-3-[3-(trifluoromethoxy)phenyl]urea
CID 58817774
N-ethyl-2-[[2-(3-methoxyanilino)-2-oxoethyl]amino]acetamide
CID 43401692
1-(3,3-dimethyl-2-oxobutyl)-3-(3-methoxyphenyl)urea
CID 60733422
1-(3-methoxyphenyl)-3-(4-methoxyphenyl)urea
CID 872322
N-[3-[(3-methoxyphenyl)carbamoylamino]phenyl]acetamide
CID 6467465
1-[3-(cyanomethoxy)phenyl]-3-ethylurea
CID 43175550
1-(3-methoxyphenyl)-3-[(4-methylphenyl)methyl]urea
CID 3785527
1-(3-methoxyphenyl)-3-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]urea
CID 100746710
1-(3-aminopentyl)-3-(3-methoxyphenyl)urea
CID 113498087
1-cyano-3-(3-methoxyphenyl)urea
CID 22351200
ethyl N-[(3-methoxyphenyl)carbamoyl]carbamate
CID 13221153

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea?
The IUPAC name of 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea (CID 18977622) is 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea.
What is the SMILES notation for 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea?
The canonical SMILES for 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea is CCNC(=O)Nc1cccc(-c2cccc(OC)c2)c1.
What is the InChIKey of 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea?
The InChIKey is QGYPOISDBGVYSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-3-17-16(19)18-14-8-4-6-12(10-14)13-7-5-9-15(11-13)20-2/h4-11H,3H2,1-2H3,(H2,17,18,19).
What are the key properties of 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea?
1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea has a molecular weight of 270.33 g/mol, XLogP of 3.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[3-(3-methoxyphenyl)phenyl]urea is sourced from PubChem (CID 18977622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).