6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine

C27H22F2N4 — CID 90924580

IUPAC6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
SMILESFc1ccc(-c2cnc3c(ncn3C3CCNCC3)c2-c2ccc3ccccc3c2)c(F)c1
InChIInChI=1S/C27H22F2N4/c28-20-7-8-22(24(29)14-20)23-15-31-27-26(32-16-33(27)21-9-11-30-12-10-21)25(23)19-6-5-17-3-1-2-4-18(17)13-19/h1-8,13-16,21,30H,9-12H2
InChIKeyRFELQWTWHIOYCC-UHFFFAOYSA-N
MW440.50 g/mol
LogP6.12
Rot. Bonds3

About 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine

6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine (PubChem CID 90924580) has the molecular formula C27H22F2N4 and a molecular weight of 440.50 g/mol. Its IUPAC name is 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
PubChem CID90924580
Molecular FormulaC27H22F2N4
Molecular Weight440.50 g/mol
Exact Mass440.18
IUPAC Name6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
SMILESFc1ccc(-c2cnc3c(ncn3C3CCNCC3)c2-c2ccc3ccccc3c2)c(F)c1
InChIInChI=1S/C27H22F2N4/c28-20-7-8-22(24(29)14-20)23-15-31-27-26(32-16-33(27)21-9-11-30-12-10-21)25(23)19-6-5-17-3-1-2-4-18(17)13-19/h1-8,13-16,21,30H,9-12H2
InChIKeyRFELQWTWHIOYCC-UHFFFAOYSA-N
XLogP6.12
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.50
LogP ≤ 56.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine with MolForge

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Related Compounds

6-(3-chlorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 91497617
2-(4-fluorophenyl)-6-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 57425385
7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine
CID 57462542
2-(2,4-difluorophenyl)naphthalene
CID 57155988
4-(2-naphthalen-2-ylimidazol-1-yl)piperidine
CID 68729306
2-(4-methylphenyl)-6-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 57425345
2-(2-bromophenyl)-6-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 57425400
N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide
CID 57425327
3-(7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridin-2-yl)quinoline
CID 25211297
2-(4-methoxyphenyl)-6-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 57425370
4-[5-(4-fluorophenyl)-3-piperidin-4-ylimidazol-4-yl]-2-phenylsulfanylpyridine
CID 15872410
6-naphthalen-2-yl-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine
CID 57425348

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine?
The IUPAC name of 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine (CID 90924580) is 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine is Fc1ccc(-c2cnc3c(ncn3C3CCNCC3)c2-c2ccc3ccccc3c2)c(F)c1.
What is the InChIKey of 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine?
The InChIKey is RFELQWTWHIOYCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22F2N4/c28-20-7-8-22(24(29)14-20)23-15-31-27-26(32-16-33(27)21-9-11-30-12-10-21)25(23)19-6-5-17-3-1-2-4-18(17)13-19/h1-8,13-16,21,30H,9-12H2.
What are the key properties of 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine?
6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine has a molecular weight of 440.50 g/mol, XLogP of 6.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-difluorophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 90924580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).