1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea

C15H17N3O3 — CID 769338

IUPAC1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea
SMILESCOc1ccc(NC(=O)Nc2cccc(C)n2)c(OC)c1
InChIInChI=1S/C15H17N3O3/c1-10-5-4-6-14(16-10)18-15(19)17-12-8-7-11(20-2)9-13(12)21-3/h4-9H,1-3H3,(H2,16,17,18,19)
InChIKeyZJEKIHLYSCXUML-UHFFFAOYSA-N
MW287.32 g/mol
LogP3.05
Rot. Bonds4

About 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea

1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea (PubChem CID 769338) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea.

Molecular Properties

Compound Name1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea
PubChem CID769338
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea
SMILESCOc1ccc(NC(=O)Nc2cccc(C)n2)c(OC)c1
InChIInChI=1S/C15H17N3O3/c1-10-5-4-6-14(16-10)18-15(19)17-12-8-7-11(20-2)9-13(12)21-3/h4-9H,1-3H3,(H2,16,17,18,19)
InChIKeyZJEKIHLYSCXUML-UHFFFAOYSA-N
XLogP3.05
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,4-dimethoxyphenyl)-3-(4-methoxy-1,3-benzothiazol-2-yl)urea
CID 121080247
N-(2-methoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 44997668
1-cyano-3-(2,4-dimethoxyphenyl)urea
CID 20559814
2-amino-3,5-dimethoxy-N-(6-methyl-2-pyridinyl)benzamide
CID 115950448
2-(4-methoxyphenoxy)-N-(6-methyl-2-pyridinyl)acetamide
CID 3146339
1-(2,4-dimethoxyphenyl)-3-(4-iodophenyl)urea
CID 2209592
N-(2,5-dimethoxyphenyl)-6-methylpyridine-2-carboxamide
CID 31808969
N-(2,4-dimethoxyphenyl)-3-methylbenzamide
CID 710450
1-(2,4-dimethoxyphenyl)-3-(4-propan-2-yl-1,3-benzothiazol-2-yl)urea
CID 121081368
1-(2,4-dimethoxyphenyl)-3-(4,5-dimethyl-1,3-benzothiazol-2-yl)urea
CID 121080700
N'-(2,4-dimethoxyphenyl)-N-(3-methoxyphenyl)oxamide
CID 44998139
1-(2,4-dimethoxyphenyl)-3-(propan-2-ylideneamino)urea
CID 11988328

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea?
The IUPAC name of 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea (CID 769338) is 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea.
What is the SMILES notation for 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea?
The canonical SMILES for 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea is COc1ccc(NC(=O)Nc2cccc(C)n2)c(OC)c1.
What is the InChIKey of 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea?
The InChIKey is ZJEKIHLYSCXUML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10-5-4-6-14(16-10)18-15(19)17-12-8-7-11(20-2)9-13(12)21-3/h4-9H,1-3H3,(H2,16,17,18,19).
What are the key properties of 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea?
1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea has a molecular weight of 287.32 g/mol, XLogP of 3.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethoxyphenyl)-3-(6-methyl-2-pyridinyl)urea is sourced from PubChem (CID 769338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).