1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea

C17H20N2O2 — CID 46860194

IUPAC1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea
SMILESCOc1ccc(NC(=O)Nc2cccc(C)c2C)c(C)c1
InChIInChI=1S/C17H20N2O2/c1-11-6-5-7-16(13(11)3)19-17(20)18-15-9-8-14(21-4)10-12(15)2/h5-10H,1-4H3,(H2,18,19,20)
InChIKeyHYFLNDIXFVRMCU-UHFFFAOYSA-N
MW284.36 g/mol
LogP4.26
Rot. Bonds3

About 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea

1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea (PubChem CID 46860194) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea.

Molecular Properties

Compound Name1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea
PubChem CID46860194
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea
SMILESCOc1ccc(NC(=O)Nc2cccc(C)c2C)c(C)c1
InChIInChI=1S/C17H20N2O2/c1-11-6-5-7-16(13(11)3)19-17(20)18-15-9-8-14(21-4)10-12(15)2/h5-10H,1-4H3,(H2,18,19,20)
InChIKeyHYFLNDIXFVRMCU-UHFFFAOYSA-N
XLogP4.26
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxy-2-methylphenyl)-3-(3-methylphenyl)urea
CID 46860185
1-(4-methoxy-2-methylphenyl)-3-propan-2-ylurea
CID 115606016
1-amino-3-(4-methoxy-2-methylphenyl)urea
CID 62872642
1-(2,4-difluorophenyl)-3-(4-methoxy-2-methylphenyl)urea
CID 972200
N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide
CID 44995875
1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea
CID 6469067
1-(4-acetylphenyl)-3-(4-methoxy-2-methylphenyl)urea
CID 2954642
N-(2,3-dimethylphenyl)-2-(4-methoxyphenoxy)propanamide
CID 2789567
[2-[(2,3-dimethylphenyl)carbamoylamino]-2-oxoethyl] 3-methoxybenzoate
CID 40762758
1-(4-methoxy-2-methylphenyl)-3-(2-methylphenyl)thiourea
CID 19678122
1-(4-chloro-2,5-dimethoxyphenyl)-3-(4-methoxy-2-methylphenyl)urea
CID 46860261
(2S)-N-(2,3-dimethylphenyl)-2-(3-methoxyphenoxy)butanamide
CID 93488485

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea?
The IUPAC name of 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea (CID 46860194) is 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea.
What is the SMILES notation for 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea?
The canonical SMILES for 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea is COc1ccc(NC(=O)Nc2cccc(C)c2C)c(C)c1.
What is the InChIKey of 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea?
The InChIKey is HYFLNDIXFVRMCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-11-6-5-7-16(13(11)3)19-17(20)18-15-9-8-14(21-4)10-12(15)2/h5-10H,1-4H3,(H2,18,19,20).
What are the key properties of 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea?
1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea has a molecular weight of 284.36 g/mol, XLogP of 4.26, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea is sourced from PubChem (CID 46860194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).