1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea

C19H23N3O2 — CID 108991302

IUPAC1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea
SMILESCc1ccc(NC(=O)Nc2ccccc2N2CCOCC2)c(C)c1
InChIInChI=1S/C19H23N3O2/c1-14-7-8-16(15(2)13-14)20-19(23)21-17-5-3-4-6-18(17)22-9-11-24-12-10-22/h3-8,13H,9-12H2,1-2H3,(H2,20,21,23)
InChIKeyHQZDGCZSTBYHMP-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.78
Rot. Bonds3

About 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea

1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea (PubChem CID 108991302) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea
PubChem CID108991302
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea
SMILESCc1ccc(NC(=O)Nc2ccccc2N2CCOCC2)c(C)c1
InChIInChI=1S/C19H23N3O2/c1-14-7-8-16(15(2)13-14)20-19(23)21-17-5-3-4-6-18(17)22-9-11-24-12-10-22/h3-8,13H,9-12H2,1-2H3,(H2,20,21,23)
InChIKeyHQZDGCZSTBYHMP-UHFFFAOYSA-N
XLogP3.78
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-4-methylphenyl)-N'-(2-morpholin-4-ylphenyl)oxamide
CID 108527553
N-(2-bromo-4-methylphenyl)-N'-(2-morpholin-4-ylphenyl)oxamide
CID 108527541
(2S)-N-(2,4-dimethylphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
CID 25468215
3,5-dimethyl-N-(2-morpholin-4-ylphenyl)benzamide
CID 969408
1-[(2-methylphenyl)methyl]-3-(2-morpholin-4-ylphenyl)urea
CID 108897210
4-(2,5-dimethylphenyl)-N-(2-morpholin-4-ylphenyl)-4-oxobutanamide
CID 17459754
2-methyl-N-(2-morpholin-4-ylphenyl)propanamide
CID 2767049
N-(2-morpholin-4-ylphenyl)-3-(2,4,6-trimethylanilino)propanamide
CID 109037056
2-(N-acetyl-2,4,6-trimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 113170062
1-(2-morpholin-4-ylphenyl)-3-propylurea
CID 110755134
1-(2-methylphenyl)-3-(2-piperidin-1-ylphenyl)urea
CID 2814230
1-(2-morpholin-4-ylphenyl)-3-(2-propan-2-yloxyphenyl)urea
CID 108992097

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea?
The IUPAC name of 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea (CID 108991302) is 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea?
The canonical SMILES for 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea is Cc1ccc(NC(=O)Nc2ccccc2N2CCOCC2)c(C)c1.
What is the InChIKey of 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea?
The InChIKey is HQZDGCZSTBYHMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-14-7-8-16(15(2)13-14)20-19(23)21-17-5-3-4-6-18(17)22-9-11-24-12-10-22/h3-8,13H,9-12H2,1-2H3,(H2,20,21,23).
What are the key properties of 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea?
1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea has a molecular weight of 325.41 g/mol, XLogP of 3.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea is sourced from PubChem (CID 108991302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).