2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine

C30H27N5 — CID 25211716

IUPAC2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
SMILESCn1cc(-c2nc3c(-c4ccc5ccccc5c4)ccnc3n2C2CCNCC2)c2ccccc21
InChIInChI=1S/C30H27N5/c1-34-19-26(25-8-4-5-9-27(25)34)29-33-28-24(22-11-10-20-6-2-3-7-21(20)18-22)14-17-32-30(28)35(29)23-12-15-31-16-13-23/h2-11,14,17-19,23,31H,12-13,15-16H2,1H3
InChIKeyNICMBQXIVPHZKV-UHFFFAOYSA-N
MW457.58 g/mol
LogP6.33
Rot. Bonds3

About 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine

2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine (PubChem CID 25211716) has the molecular formula C30H27N5 and a molecular weight of 457.58 g/mol. Its IUPAC name is 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
PubChem CID25211716
Molecular FormulaC30H27N5
Molecular Weight457.58 g/mol
Exact Mass457.23
IUPAC Name2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
SMILESCn1cc(-c2nc3c(-c4ccc5ccccc5c4)ccnc3n2C2CCNCC2)c2ccccc21
InChIInChI=1S/C30H27N5/c1-34-19-26(25-8-4-5-9-27(25)34)29-33-28-24(22-11-10-20-6-2-3-7-21(20)18-22)14-17-32-30(28)35(29)23-12-15-31-16-13-23/h2-11,14,17-19,23,31H,12-13,15-16H2,1H3
InChIKeyNICMBQXIVPHZKV-UHFFFAOYSA-N
XLogP6.33
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500457.58
LogP ≤ 56.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-bromophenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 25212217
2-(3-methylphenyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 57425309
3-(7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridin-2-yl)quinoline
CID 25211297
2-(2-methoxy-3-pyridinyl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 25211717
5-(7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridin-2-yl)-1H-pyrimidine-2,4-dione
CID 135949391
7-naphthalen-2-yl-2-(3-phenoxyphenyl)-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 25212313
7-naphthalen-2-yl-2-(3-nitrophenyl)-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 25212023
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
2-(4-methoxyphenyl)-6-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 57425370
(3R)-3-(2-methyl-7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)pyrrolidine-1-carboxylic acid
CID 68726411
7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine
CID 57462542

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine?
The IUPAC name of 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine (CID 25211716) is 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine is Cn1cc(-c2nc3c(-c4ccc5ccccc5c4)ccnc3n2C2CCNCC2)c2ccccc21.
What is the InChIKey of 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine?
The InChIKey is NICMBQXIVPHZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H27N5/c1-34-19-26(25-8-4-5-9-27(25)34)29-33-28-24(22-11-10-20-6-2-3-7-21(20)18-22)14-17-32-30(28)35(29)23-12-15-31-16-13-23/h2-11,14,17-19,23,31H,12-13,15-16H2,1H3.
What are the key properties of 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine?
2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine has a molecular weight of 457.58 g/mol, XLogP of 6.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylindol-3-yl)-7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 25211716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).