2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine

C38H32F2N8O2 — CID 138482923

IUPAC2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine
SMILESCOc1ccn2cc(C3CC3c3cn4ccc(OCc5cc(F)c6nc(C7CC7c7cn8cccc(F)c8n7)cn6c5)c(C)c4n3)nc2c1C
InChIInChI=1S/C38H32F2N8O2/c1-20-33(49-3)6-9-46-16-29(41-35(20)46)23-12-24(23)30-17-47-10-7-34(21(2)36(47)42-30)50-19-22-11-28(40)38-44-32(18-48(38)14-22)26-13-25(26)31-15-45-8-4-5-27(39)37(45)43-31/h4-11,14-18,23-26H,12-13,19H2,1-3H3
InChIKeyKOMVXLURCJCECJ-UHFFFAOYSA-N
MW670.72 g/mol
LogP7.30
Rot. Bonds8

About 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine

2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine (PubChem CID 138482923) has the molecular formula C38H32F2N8O2 and a molecular weight of 670.72 g/mol. Its IUPAC name is 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine
PubChem CID138482923
Molecular FormulaC38H32F2N8O2
Molecular Weight670.72 g/mol
Exact Mass670.26
IUPAC Name2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine
SMILESCOc1ccn2cc(C3CC3c3cn4ccc(OCc5cc(F)c6nc(C7CC7c7cn8cccc(F)c8n7)cn6c5)c(C)c4n3)nc2c1C
InChIInChI=1S/C38H32F2N8O2/c1-20-33(49-3)6-9-46-16-29(41-35(20)46)23-12-24(23)30-17-47-10-7-34(21(2)36(47)42-30)50-19-22-11-28(40)38-44-32(18-48(38)14-22)26-13-25(26)31-15-45-8-4-5-27(39)37(45)43-31/h4-11,14-18,23-26H,12-13,19H2,1-3H3
InChIKeyKOMVXLURCJCECJ-UHFFFAOYSA-N
XLogP7.30
TPSA87.66 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500670.72
LogP ≤ 57.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine?
The IUPAC name of 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine (CID 138482923) is 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine is COc1ccn2cc(C3CC3c3cn4ccc(OCc5cc(F)c6nc(C7CC7c7cn8cccc(F)c8n7)cn6c5)c(C)c4n3)nc2c1C.
What is the InChIKey of 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine?
The InChIKey is KOMVXLURCJCECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H32F2N8O2/c1-20-33(49-3)6-9-46-16-29(41-35(20)46)23-12-24(23)30-17-47-10-7-34(21(2)36(47)42-30)50-19-22-11-28(40)38-44-32(18-48(38)14-22)26-13-25(26)31-15-45-8-4-5-27(39)37(45)43-31/h4-11,14-18,23-26H,12-13,19H2,1-3H3.
What are the key properties of 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine?
2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine has a molecular weight of 670.72 g/mol, XLogP of 7.30, 8 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[7-[[8-fluoro-2-[2-(8-fluoroimidazo[1,2-a]pyridin-2-yl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]methoxy]-8-methylimidazo[1,2-a]pyridin-2-yl]cyclopropyl]-7-methoxy-8-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 138482923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).