4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide

C23H22N4O3 — CID 167810018

IUPAC4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2cccc(-c3ccc(C)cc3)n2)cc1N1CCNC1=O
InChIInChI=1S/C23H22N4O3/c1-15-6-8-16(9-7-15)18-4-3-5-21(25-18)26-22(28)17-10-11-20(30-2)19(14-17)27-13-12-24-23(27)29/h3-11,14H,12-13H2,1-2H3,(H,24,29)(H,25,26,28)
InChIKeyDIDYCANFBXJLLF-UHFFFAOYSA-N
MW402.45 g/mol
LogP3.85
Rot. Bonds5

About 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide

4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide (PubChem CID 167810018) has the molecular formula C23H22N4O3 and a molecular weight of 402.45 g/mol. Its IUPAC name is 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide.

Molecular Properties

Compound Name4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide
PubChem CID167810018
Molecular FormulaC23H22N4O3
Molecular Weight402.45 g/mol
Exact Mass402.17
IUPAC Name4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2cccc(-c3ccc(C)cc3)n2)cc1N1CCNC1=O
InChIInChI=1S/C23H22N4O3/c1-15-6-8-16(9-7-15)18-4-3-5-21(25-18)26-22(28)17-10-11-20(30-2)19(14-17)27-13-12-24-23(27)29/h3-11,14H,12-13H2,1-2H3,(H,24,29)(H,25,26,28)
InChIKeyDIDYCANFBXJLLF-UHFFFAOYSA-N
XLogP3.85
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.45
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The IUPAC name of 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide (CID 167810018) is 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide.
What is the SMILES notation for 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The canonical SMILES for 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide is COc1ccc(C(=O)Nc2cccc(-c3ccc(C)cc3)n2)cc1N1CCNC1=O.
What is the InChIKey of 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The InChIKey is DIDYCANFBXJLLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O3/c1-15-6-8-16(9-7-15)18-4-3-5-21(25-18)26-22(28)17-10-11-20(30-2)19(14-17)27-13-12-24-23(27)29/h3-11,14H,12-13H2,1-2H3,(H,24,29)(H,25,26,28).
What are the key properties of 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide has a molecular weight of 402.45 g/mol, XLogP of 3.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[6-(4-methylphenyl)-2-pyridinyl]-3-(2-oxoimidazolidin-1-yl)benzamide is sourced from PubChem (CID 167810018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).