N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide

C24H23N3O5 — CID 46948418

IUPACN-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide
SMILESCOc1cccc(-c2cc(NC=O)c3ncc(-c4cc(OC)c(OC)c(OC)c4)n3c2)c1
InChIInChI=1S/C24H23N3O5/c1-29-18-7-5-6-15(8-18)17-9-19(26-14-28)24-25-12-20(27(24)13-17)16-10-21(30-2)23(32-4)22(11-16)31-3/h5-14H,1-4H3,(H,26,28)
InChIKeyODTVZWQJBYHSKN-UHFFFAOYSA-N
MW433.46 g/mol
LogP4.27
Rot. Bonds8

About N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide

N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide (PubChem CID 46948418) has the molecular formula C24H23N3O5 and a molecular weight of 433.46 g/mol. Its IUPAC name is N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide.

Molecular Properties

Compound NameN-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide
PubChem CID46948418
Molecular FormulaC24H23N3O5
Molecular Weight433.46 g/mol
Exact Mass433.16
IUPAC NameN-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide
SMILESCOc1cccc(-c2cc(NC=O)c3ncc(-c4cc(OC)c(OC)c(OC)c4)n3c2)c1
InChIInChI=1S/C24H23N3O5/c1-29-18-7-5-6-15(8-18)17-9-19(26-14-28)24-25-12-20(27(24)13-17)16-10-21(30-2)23(32-4)22(11-16)31-3/h5-14H,1-4H3,(H,26,28)
InChIKeyODTVZWQJBYHSKN-UHFFFAOYSA-N
XLogP4.27
TPSA83.32 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.46
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide?
The IUPAC name of N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide (CID 46948418) is N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide.
What is the SMILES notation for N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide?
The canonical SMILES for N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide is COc1cccc(-c2cc(NC=O)c3ncc(-c4cc(OC)c(OC)c(OC)c4)n3c2)c1.
What is the InChIKey of N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide?
The InChIKey is ODTVZWQJBYHSKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O5/c1-29-18-7-5-6-15(8-18)17-9-19(26-14-28)24-25-12-20(27(24)13-17)16-10-21(30-2)23(32-4)22(11-16)31-3/h5-14H,1-4H3,(H,26,28).
What are the key properties of N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide?
N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide has a molecular weight of 433.46 g/mol, XLogP of 4.27, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]formamide is sourced from PubChem (CID 46948418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).