[4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone

C22H23N5O — CID 95826189

IUPAC[4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone
SMILESCCc1nc2cccnc2n1C1CCN(C(=O)c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/C22H23N5O/c1-2-20-25-18-8-5-11-23-21(18)27(20)16-9-12-26(13-10-16)22(28)19-14-15-6-3-4-7-17(15)24-19/h3-8,11,14,16,24H,2,9-10,12-13H2,1H3
InChIKeyOCDFKGGJVSPRQM-UHFFFAOYSA-N
MW373.46 g/mol
LogP3.95
Rot. Bonds3

About [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone

[4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone (PubChem CID 95826189) has the molecular formula C22H23N5O and a molecular weight of 373.46 g/mol. Its IUPAC name is [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone.

Molecular Properties

Compound Name[4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone
PubChem CID95826189
Molecular FormulaC22H23N5O
Molecular Weight373.46 g/mol
Exact Mass373.19
IUPAC Name[4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone
SMILESCCc1nc2cccnc2n1C1CCN(C(=O)c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/C22H23N5O/c1-2-20-25-18-8-5-11-23-21(18)27(20)16-9-12-26(13-10-16)22(28)19-14-15-6-3-4-7-17(15)24-19/h3-8,11,14,16,24H,2,9-10,12-13H2,1H3
InChIKeyOCDFKGGJVSPRQM-UHFFFAOYSA-N
XLogP3.95
TPSA66.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(5-methoxy-1H-indol-2-yl)methanone
CID 95826190
(5-fluoro-1H-indol-2-yl)-[(3R)-3-(2-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-1-yl]methanone
CID 95826223
(5-methoxy-1H-indol-2-yl)-[3-(2-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-1-yl]methanone
CID 110257772
[4-[2-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-3-yl]piperidin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone
CID 42479295
4-(2-ethylimidazo[4,5-b]pyridin-3-yl)thiane 1,1-dioxide
CID 117165614
N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]acetamide
CID 49349124
ethyl 2-[[(3S)-3-(2-ethylimidazo[4,5-b]pyridin-3-yl)pyrrolidine-1-carbonyl]amino]acetate
CID 95108456
[1-[(2-aminopyrimidin-5-yl)methyl]piperidin-4-yl]-[4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]methanone
CID 21050175
1H-indol-2-yl-[4-(methylaminomethyl)piperidin-1-yl]methanone
CID 63250609
ethyl 4-[[(3R)-3-(2-ethylimidazo[4,5-b]pyridin-3-yl)pyrrolidine-1-carbonyl]amino]benzoate
CID 95108453
ethyl 4-(2-methylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxylate;ethyl 4-(2-oxo-1H-imidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxylate
CID 157147875
3-[2-oxo-2-[4-(2-propylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]ethyl]-2,3-dihydroisoindol-1-one
CID 45166050

Frequently Asked Questions

What is the IUPAC name of [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone?
The IUPAC name of [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone (CID 95826189) is [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone.
What is the SMILES notation for [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone?
The canonical SMILES for [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone is CCc1nc2cccnc2n1C1CCN(C(=O)c2cc3ccccc3[nH]2)CC1.
What is the InChIKey of [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone?
The InChIKey is OCDFKGGJVSPRQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O/c1-2-20-25-18-8-5-11-23-21(18)27(20)16-9-12-26(13-10-16)22(28)19-14-15-6-3-4-7-17(15)24-19/h3-8,11,14,16,24H,2,9-10,12-13H2,1H3.
What are the key properties of [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone?
[4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone has a molecular weight of 373.46 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-ethylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]-(1H-indol-2-yl)methanone is sourced from PubChem (CID 95826189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).