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

C19H24N2O — CID 3766021

IUPAC1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea
SMILESCc1ccc(CCNC(=O)Nc2ccc(C)cc2C)c(C)c1
InChIInChI=1S/C19H24N2O/c1-13-5-7-17(15(3)11-13)9-10-20-19(22)21-18-8-6-14(2)12-16(18)4/h5-8,11-12H,9-10H2,1-4H3,(H2,20,21,22)
InChIKeyQWWKNDDAICQRQH-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.28
Rot. Bonds4

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

1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea (PubChem CID 3766021) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea
PubChem CID3766021
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea
SMILESCc1ccc(CCNC(=O)Nc2ccc(C)cc2C)c(C)c1
InChIInChI=1S/C19H24N2O/c1-13-5-7-17(15(3)11-13)9-10-20-19(22)21-18-8-6-14(2)12-16(18)4/h5-8,11-12H,9-10H2,1-4H3,(H2,20,21,22)
InChIKeyQWWKNDDAICQRQH-UHFFFAOYSA-N
XLogP4.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-tert-butylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea
CID 5094331
1-[2-(2,4-dimethylphenyl)ethyl]-3-propylurea
CID 110775694
1-(2-hydroxy-4-methylphenyl)-3-[2-(2-methylphenyl)ethyl]urea
CID 108899779
1-(2,4-dimethylphenyl)-3-(3-oxobutyl)urea
CID 108895054
1-(2-bromo-4-methylphenyl)-3-[2-(2-methylphenyl)ethyl]urea
CID 52543091
1-(2,4-dimethylphenyl)-3-(2-methoxyethyl)urea
CID 5054028
1-(2,4-dimethylphenyl)-3-[2-(4-methoxyphenyl)ethyl]urea
CID 108901898
1-[2-(2,4-dimethylphenyl)ethyl]-3-(2-phenylethyl)urea
CID 3381220
1-(2,4-dimethylphenyl)-3-prop-2-ynylurea
CID 97180603
methyl N-[2-(2,4-dimethylphenyl)ethyl]carbamate
CID 110787753
1-[2-(2,4-dimethylphenyl)ethyl]-3-(3-ethylphenyl)urea
CID 3831940
1-butan-2-yl-3-[2-(2,4-dimethylphenyl)ethyl]urea
CID 60590409

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea?
The IUPAC name of 1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea (CID 3766021) is 1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea?
The canonical SMILES for 1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea is Cc1ccc(CCNC(=O)Nc2ccc(C)cc2C)c(C)c1.
What is the InChIKey of 1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea?
The InChIKey is QWWKNDDAICQRQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-13-5-7-17(15(3)11-13)9-10-20-19(22)21-18-8-6-14(2)12-16(18)4/h5-8,11-12H,9-10H2,1-4H3,(H2,20,21,22).
What are the key properties of 1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea?
1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea has a molecular weight of 296.41 g/mol, XLogP of 4.28, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)-3-[2-(2,4-dimethylphenyl)ethyl]urea is sourced from PubChem (CID 3766021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).