furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone

C21H18N4O2 — CID 131668798

IUPACfuran-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCCC1c1ncn2cc(-c3cccnc3)ccc12
InChIInChI=1S/C21H18N4O2/c26-21(19-6-3-11-27-19)25-10-2-5-18(25)20-17-8-7-16(13-24(17)14-23-20)15-4-1-9-22-12-15/h1,3-4,6-9,11-14,18H,2,5,10H2
InChIKeyACGINQCCXWDNJL-UHFFFAOYSA-N
MW358.40 g/mol
LogP3.97
Rot. Bonds3

About furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone

furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone (PubChem CID 131668798) has the molecular formula C21H18N4O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone
PubChem CID131668798
Molecular FormulaC21H18N4O2
Molecular Weight358.40 g/mol
Exact Mass358.14
IUPAC Namefuran-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCCC1c1ncn2cc(-c3cccnc3)ccc12
InChIInChI=1S/C21H18N4O2/c26-21(19-6-3-11-27-19)25-10-2-5-18(25)20-17-8-7-16(13-24(17)14-23-20)15-4-1-9-22-12-15/h1,3-4,6-9,11-14,18H,2,5,10H2
InChIKeyACGINQCCXWDNJL-UHFFFAOYSA-N
XLogP3.97
TPSA63.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-2-yl]-6-pyridin-3-ylimidazo[1,5-a]pyridine;bis(2,2,2-trifluoroacetic acid)
CID 155847039
2-(4-methylphenyl)-1-[4-methyl-3-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)piperazin-1-yl]ethanone
CID 131673414
[(2S)-2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-(furan-2-yl)methanone
CID 40897491
furan-2-yl-[2-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methanone
CID 42765347
[2-(4-bromophenyl)pyrrolidin-1-yl]-(furan-2-yl)methanone
CID 47313418
furan-2-yl-[2-[5-[3-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]methanone
CID 46107266
furan-2-yl-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]methanone
CID 92731513
1-(furan-2-carbonyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 17481227
furan-2-yl-[2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 60716835
furan-2-yl-[9-(pyridin-3-ylmethoxy)-2-oxa-5-azabicyclo[4.2.1]nonan-5-yl]methanone
CID 131648889
[(2S,3R)-3-(dimethylamino)-2-(pyridin-3-ylmethyl)pyrrolidin-1-yl]-(furan-2-yl)methanone
CID 97470905
[3-(2-methylpropyl)-1,2-oxazol-5-yl]-[(2S)-2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]methanone
CID 70710458

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone?
The IUPAC name of furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone (CID 131668798) is furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone is O=C(c1ccco1)N1CCCC1c1ncn2cc(-c3cccnc3)ccc12.
What is the InChIKey of furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone?
The InChIKey is ACGINQCCXWDNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O2/c26-21(19-6-3-11-27-19)25-10-2-5-18(25)20-17-8-7-16(13-24(17)14-23-20)15-4-1-9-22-12-15/h1,3-4,6-9,11-14,18H,2,5,10H2.
What are the key properties of furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone?
furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone has a molecular weight of 358.40 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[2-(6-pyridin-3-ylimidazo[1,5-a]pyridin-1-yl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 131668798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).