6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one

C22H21N3O5 — CID 155557161

IUPAC6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one
SMILESCOc1ccc(-c2cc3c(cn2)[nH]c(=O)n3-c2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C22H21N3O5/c1-27-15-7-5-13(6-8-15)16-11-18-17(12-23-16)24-22(26)25(18)14-9-19(28-2)21(30-4)20(10-14)29-3/h5-12H,1-4H3,(H,24,26)
InChIKeyXGYGPLIJNGOLKU-UHFFFAOYSA-N
MW407.43 g/mol
LogP3.42
Rot. Bonds6

About 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one

6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one (PubChem CID 155557161) has the molecular formula C22H21N3O5 and a molecular weight of 407.43 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one.

Molecular Properties

Compound Name6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one
PubChem CID155557161
Molecular FormulaC22H21N3O5
Molecular Weight407.43 g/mol
Exact Mass407.15
IUPAC Name6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one
SMILESCOc1ccc(-c2cc3c(cn2)[nH]c(=O)n3-c2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C22H21N3O5/c1-27-15-7-5-13(6-8-15)16-11-18-17(12-23-16)24-22(26)25(18)14-9-19(28-2)21(30-4)20(10-14)29-3/h5-12H,1-4H3,(H,24,26)
InChIKeyXGYGPLIJNGOLKU-UHFFFAOYSA-N
XLogP3.42
TPSA87.60 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.43
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one with MolForge

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Related Compounds

N-(3-{5-[(3,4,5-trimethoxyphenyl)amino]pyridin-3-yl}phenyl)acetamide
CID 11574718
6,7-dimethoxy-N-(3,4,5-trimethoxyphenyl)quinolin-4-amine
CID 5330475
3-{6-[(3,4,5-Trimethoxyphenyl)amino]pyrazin-2-yl}phenol
CID 11595532
Acetamide, N-[3-[6-[(3,4,5-trimethoxyphenyl)amino]pyrazinyl]phenyl]-
CID 11682654
1-Phenyl-3-(4-{6-[(3,4,5-trimethoxyphenyl)amino]pyrazin-2-yl}phenyl)urea
CID 24879141
1-Quinolin-8-yl-3-(3,4,5-trimethoxyphenyl)urea
CID 1075620
N-methyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
CID 4983788
5-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-1H-imidazole
CID 11290749
3-{3-[(4-Methoxyphenyl)methyl]-3H-imidazo[4,5-B]pyridin-2-YL}-N-(3,4,5-trimethoxyphenyl)propanamide
CID 16009029
5-Methoxy-2-(4,5,6-trimethoxyindol-1-yl)aniline
CID 54768149
4,5,6-Trimethoxy-1-(6-methoxy-1-methylindol-3-yl)indole
CID 54768183
1-(Pyridin-4-ylmethyl)-3-(3,4,5-trimethoxyphenyl)urea
CID 2330745

Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one?
The IUPAC name of 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one (CID 155557161) is 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one.
What is the SMILES notation for 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one?
The canonical SMILES for 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one is COc1ccc(-c2cc3c(cn2)[nH]c(=O)n3-c2cc(OC)c(OC)c(OC)c2)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one?
The InChIKey is XGYGPLIJNGOLKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O5/c1-27-15-7-5-13(6-8-15)16-11-18-17(12-23-16)24-22(26)25(18)14-9-19(28-2)21(30-4)20(10-14)29-3/h5-12H,1-4H3,(H,24,26).
What are the key properties of 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one?
6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one has a molecular weight of 407.43 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-3H-imidazo[4,5-c]pyridin-2-one is sourced from PubChem (CID 155557161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).