[2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone

C22H29N5O2 — CID 166373446

IUPAC[2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone
SMILESCN1CCCC1C(=O)N1CCC2(CCN(C(=O)c3cnc4ccccn34)C2)CC1
InChIInChI=1S/C22H29N5O2/c1-24-10-4-5-17(24)20(28)25-12-7-22(8-13-25)9-14-26(16-22)21(29)18-15-23-19-6-2-3-11-27(18)19/h2-3,6,11,15,17H,4-5,7-10,12-14,16H2,1H3
InChIKeyGAKIOMITNBCHHA-UHFFFAOYSA-N
MW395.51 g/mol
LogP1.88
Rot. Bonds2

About [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone

[2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone (PubChem CID 166373446) has the molecular formula C22H29N5O2 and a molecular weight of 395.51 g/mol. Its IUPAC name is [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone.

Molecular Properties

Compound Name[2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone
PubChem CID166373446
Molecular FormulaC22H29N5O2
Molecular Weight395.51 g/mol
Exact Mass395.23
IUPAC Name[2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone
SMILESCN1CCCC1C(=O)N1CCC2(CCN(C(=O)c3cnc4ccccn34)C2)CC1
InChIInChI=1S/C22H29N5O2/c1-24-10-4-5-17(24)20(28)25-12-7-22(8-13-25)9-14-26(16-22)21(29)18-15-23-19-6-2-3-11-27(18)19/h2-3,6,11,15,17H,4-5,7-10,12-14,16H2,1H3
InChIKeyGAKIOMITNBCHHA-UHFFFAOYSA-N
XLogP1.88
TPSA61.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.51
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-(imidazo[1,2-a]pyridine-3-carbonyl)-1,4-diazepan-1-yl]ethanone
CID 97226980
[(2S)-1-methylpyrrolidin-2-yl]-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]methanone
CID 138808781
imidazo[1,2-a]pyridin-3-yl-[4-(4-methylpiperazine-1-carbonyl)phenyl]methanone
CID 46846990
imidazo[1,2-a]pyridin-3-yl-[3-[(3-methoxyphenoxy)methyl]piperidin-1-yl]methanone
CID 70748196
3-hexyl-8-(imidazo[1,2-a]pyridine-3-carbonyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 70753122
(2S)-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N,1-dimethylazepane-2-carboxamide
CID 97135605
[4-[5-[(dimethylamino)methyl]-4-methyl-1,2,4-triazol-3-yl]piperidin-1-yl]-imidazo[1,2-a]pyridin-3-ylmethanone
CID 70769055
1-(1-methylpiperidine-2-carbonyl)-4-phenoxypiperidine-4-carboxylic acid
CID 56887966
[1-[2-(dimethylamino)ethyl]-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl]-imidazo[1,2-a]pyridin-3-ylmethanone
CID 97396311
azepan-1-yl-(1-methylpyrrolidin-2-yl)methanone
CID 110856335
(1-methylpiperidin-2-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 110854882
3-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one
CID 94612979

Frequently Asked Questions

What is the IUPAC name of [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone?
The IUPAC name of [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone (CID 166373446) is [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone.
What is the SMILES notation for [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone?
The canonical SMILES for [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone is CN1CCCC1C(=O)N1CCC2(CCN(C(=O)c3cnc4ccccn34)C2)CC1.
What is the InChIKey of [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone?
The InChIKey is GAKIOMITNBCHHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N5O2/c1-24-10-4-5-17(24)20(28)25-12-7-22(8-13-25)9-14-26(16-22)21(29)18-15-23-19-6-2-3-11-27(18)19/h2-3,6,11,15,17H,4-5,7-10,12-14,16H2,1H3.
What are the key properties of [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone?
[2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone has a molecular weight of 395.51 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(imidazo[1,2-a]pyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-(1-methylpyrrolidin-2-yl)methanone is sourced from PubChem (CID 166373446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).