[4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone

C25H20FN9O — CID 170333041

IUPAC[4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone
SMILESCn1cc(-c2ccc3c(C(=O)N4CCc5[nH]cnc5C4c4cc5c(F)cccn5n4)cnn3c2)cn1
InChIInChI=1S/C25H20FN9O/c1-32-12-16(10-29-32)15-4-5-21-17(11-30-35(21)13-15)25(36)33-8-6-19-23(28-14-27-19)24(33)20-9-22-18(26)3-2-7-34(22)31-20/h2-5,7,9-14,24H,6,8H2,1H3,(H,27,28)
InChIKeyBQGOTVZSDISZDJ-UHFFFAOYSA-N
MW481.50 g/mol
LogP3.03
Rot. Bonds3

About [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone

[4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone (PubChem CID 170333041) has the molecular formula C25H20FN9O and a molecular weight of 481.50 g/mol. Its IUPAC name is [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone.

Molecular Properties

Compound Name[4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone
PubChem CID170333041
Molecular FormulaC25H20FN9O
Molecular Weight481.50 g/mol
Exact Mass481.18
IUPAC Name[4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone
SMILESCn1cc(-c2ccc3c(C(=O)N4CCc5[nH]cnc5C4c4cc5c(F)cccn5n4)cnn3c2)cn1
InChIInChI=1S/C25H20FN9O/c1-32-12-16(10-29-32)15-4-5-21-17(11-30-35(21)13-15)25(36)33-8-6-19-23(28-14-27-19)24(33)20-9-22-18(26)3-2-7-34(22)31-20/h2-5,7,9-14,24H,6,8H2,1H3,(H,27,28)
InChIKeyBQGOTVZSDISZDJ-UHFFFAOYSA-N
XLogP3.03
TPSA101.41 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.50
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone?
The IUPAC name of [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone (CID 170333041) is [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone.
What is the SMILES notation for [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone?
The canonical SMILES for [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone is Cn1cc(-c2ccc3c(C(=O)N4CCc5[nH]cnc5C4c4cc5c(F)cccn5n4)cnn3c2)cn1.
What is the InChIKey of [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone?
The InChIKey is BQGOTVZSDISZDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20FN9O/c1-32-12-16(10-29-32)15-4-5-21-17(11-30-35(21)13-15)25(36)33-8-6-19-23(28-14-27-19)24(33)20-9-22-18(26)3-2-7-34(22)31-20/h2-5,7,9-14,24H,6,8H2,1H3,(H,27,28).
What are the key properties of [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone?
[4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone has a molecular weight of 481.50 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone is sourced from PubChem (CID 170333041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).