1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea

C18H19N5O3 — CID 90565145

IUPAC1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea
SMILESCOc1ccc(NC(=O)Nc2ccc(-n3ccnc3C)nc2)c(OC)c1
InChIInChI=1S/C18H19N5O3/c1-12-19-8-9-23(12)17-7-4-13(11-20-17)21-18(24)22-15-6-5-14(25-2)10-16(15)26-3/h4-11H,1-3H3,(H2,21,22,24)
InChIKeyRFGOCKNHMGCIRL-UHFFFAOYSA-N
MW353.38 g/mol
LogP3.24
Rot. Bonds5

About 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea

1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea (PubChem CID 90565145) has the molecular formula C18H19N5O3 and a molecular weight of 353.38 g/mol. Its IUPAC name is 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea.

Molecular Properties

Compound Name1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea
PubChem CID90565145
Molecular FormulaC18H19N5O3
Molecular Weight353.38 g/mol
Exact Mass353.15
IUPAC Name1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea
SMILESCOc1ccc(NC(=O)Nc2ccc(-n3ccnc3C)nc2)c(OC)c1
InChIInChI=1S/C18H19N5O3/c1-12-19-8-9-23(12)17-7-4-13(11-20-17)21-18(24)22-15-6-5-14(25-2)10-16(15)26-3/h4-11H,1-3H3,(H2,21,22,24)
InChIKeyRFGOCKNHMGCIRL-UHFFFAOYSA-N
XLogP3.24
TPSA90.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-methoxy-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]benzamide
CID 90564970
2-methoxy-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]benzamide;hydrochloride
CID 71691689
2-fluoro-3-methoxy-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]benzamide
CID 75434860
1-(2,4-dimethoxyphenyl)-3-(4-iodophenyl)urea
CID 2209592
5-methyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-1,2-oxazole-3-carboxamide
CID 90565097
1-(2,4-difluorophenyl)-3-[4-[2-methyl-6-(2-methylimidazol-1-yl)pyrimidin-4-yl]oxyphenyl]urea
CID 122312694
[4-[(2,4-dimethoxyphenyl)carbamoylamino]phenyl] ethyl carbonate
CID 108865595
3,4,5-triethoxy-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]benzamide
CID 90564983
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-2,2-diphenylacetamide
CID 90565042
1-(2,4-dimethoxyphenyl)-3-(4-propan-2-ylphenyl)urea
CID 108991641
2-(cyclopropylamino)-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 60842509
1-amino-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]cyclobutane-1-carboxamide
CID 81179873

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea?
The IUPAC name of 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea (CID 90565145) is 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea.
What is the SMILES notation for 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea?
The canonical SMILES for 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea is COc1ccc(NC(=O)Nc2ccc(-n3ccnc3C)nc2)c(OC)c1.
What is the InChIKey of 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea?
The InChIKey is RFGOCKNHMGCIRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O3/c1-12-19-8-9-23(12)17-7-4-13(11-20-17)21-18(24)22-15-6-5-14(25-2)10-16(15)26-3/h4-11H,1-3H3,(H2,21,22,24).
What are the key properties of 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea?
1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea has a molecular weight of 353.38 g/mol, XLogP of 3.24, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethoxyphenyl)-3-[6-(2-methylimidazol-1-yl)-3-pyridinyl]urea is sourced from PubChem (CID 90565145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).