1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea

C19H24N2O — CID 3831940

IUPAC1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea
SMILESCCc1cccc(NC(=O)NCCc2ccc(C)cc2C)c1
InChIInChI=1S/C19H24N2O/c1-4-16-6-5-7-18(13-16)21-19(22)20-11-10-17-9-8-14(2)12-15(17)3/h5-9,12-13H,4,10-11H2,1-3H3,(H2,20,21,22)
InChIKeyPCFWYMNLKDDXFV-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.23
Rot. Bonds5

About 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea

1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea (PubChem CID 3831940) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea.

Molecular Properties

Compound Name1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea
PubChem CID3831940
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea
SMILESCCc1cccc(NC(=O)NCCc2ccc(C)cc2C)c1
InChIInChI=1S/C19H24N2O/c1-4-16-6-5-7-18(13-16)21-19(22)20-11-10-17-9-8-14(2)12-15(17)3/h5-9,12-13H,4,10-11H2,1-3H3,(H2,20,21,22)
InChIKeyPCFWYMNLKDDXFV-UHFFFAOYSA-N
XLogP4.23
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-[2-(2,4-dimethylphenyl)ethyl]-3-(2-phenylethyl)urea
CID 3381220
1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea
CID 3766021
1-[2-(2,4-dimethylphenyl)ethyl]-3-propylurea
CID 110775694
1-(3-ethylphenyl)-3-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]urea
CID 51944765
1-(2-tert-butyl-6-methylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea
CID 3672208
1-[2-(2-bromophenyl)ethyl]-3-(3-methylphenyl)urea
CID 108888015
1-(2-tert-butylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea
CID 5094331
1-[2-(2,4-dimethylphenyl)ethyl]-3-[4-(trifluoromethylsulfanyl)phenyl]urea
CID 3716909
1-[2-(2,4-dimethylphenyl)ethyl]-3-[(3-methoxyphenyl)methyl]urea
CID 48630580
N-[3-[2-(4-methylphenyl)ethylcarbamoylamino]phenyl]acetamide
CID 108884258
1-[2-(2,4-dimethylphenyl)ethyl]-3-(1-hydroxybutan-2-yl)urea
CID 48718367
2-[(3-ethylphenyl)carbamoylamino]acetamide
CID 144801383

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea?
The IUPAC name of 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea (CID 3831940) is 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea.
What is the SMILES notation for 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea?
The canonical SMILES for 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea is CCc1cccc(NC(=O)NCCc2ccc(C)cc2C)c1.
What is the InChIKey of 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea?
The InChIKey is PCFWYMNLKDDXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-4-16-6-5-7-18(13-16)21-19(22)20-11-10-17-9-8-14(2)12-15(17)3/h5-9,12-13H,4,10-11H2,1-3H3,(H2,20,21,22).
What are the key properties of 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea?
1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea has a molecular weight of 296.41 g/mol, XLogP of 4.23, 5 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea is sourced from PubChem (CID 3831940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).