[6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane

C27H23FN5P — CID 142306194

IUPAC[6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane
SMILESFC1(P)CC2(CN(c3ccc(-c4ccn5c(-c6ccnc7ccccc67)cnc5c4)cn3)C2)C1
InChIInChI=1S/C27H23FN5P/c28-27(34)14-26(15-27)16-32(17-26)24-6-5-19(12-30-24)18-8-10-33-23(13-31-25(33)11-18)21-7-9-29-22-4-2-1-3-20(21)22/h1-13H,14-17,34H2
InChIKeyLPKMDVPCSBFKNU-UHFFFAOYSA-N
MW467.49 g/mol
LogP5.75
Rot. Bonds3

About [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane

[6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane (PubChem CID 142306194) has the molecular formula C27H23FN5P and a molecular weight of 467.49 g/mol. Its IUPAC name is [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane.

Molecular Properties

Compound Name[6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane
PubChem CID142306194
Molecular FormulaC27H23FN5P
Molecular Weight467.49 g/mol
Exact Mass467.17
IUPAC Name[6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane
SMILESFC1(P)CC2(CN(c3ccc(-c4ccn5c(-c6ccnc7ccccc67)cnc5c4)cn3)C2)C1
InChIInChI=1S/C27H23FN5P/c28-27(34)14-26(15-27)16-32(17-26)24-6-5-19(12-30-24)18-8-10-33-23(13-31-25(33)11-18)21-7-9-29-22-4-2-1-3-20(21)22/h1-13H,14-17,34H2
InChIKeyLPKMDVPCSBFKNU-UHFFFAOYSA-N
XLogP5.75
TPSA46.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.49
LogP ≤ 55.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane with MolForge

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Related Compounds

2,6-dimethyl-4-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]morpholine
CID 142306273
4-[7-[6-(4-ethyl-3,3-dimethylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-2-methylquinoline
CID 134356939
1-[4-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperazin-1-yl]ethanone
CID 139326849
6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione
CID 158751069
2-methyl-4-[7-(4-piperazin-1-ylphenyl)imidazo[1,2-a]pyridin-3-yl]quinoline
CID 139326669
4-(7-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)quinoline
CID 53393073
4-[6-(6-piperidin-1-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-3-yl]quinoline
CID 118894215
4-[7-(4-piperidin-2-ylphenyl)imidazo[1,2-a]pyridin-3-yl]-1,5-naphthyridine
CID 158981917
4-[7-(4-methoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline
CID 53393051
4-[7-[4-(2,7-diazaspiro[3.5]nonan-2-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]-6,8-difluoro-2-methylquinoline
CID 139495359
4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline
CID 53393049
6-fluoro-2-methyl-4-[7-(4-piperazin-1-ylphenyl)imidazo[1,2-a]pyridin-3-yl]quinoline
CID 139326665

Frequently Asked Questions

What is the IUPAC name of [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane?
The IUPAC name of [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane (CID 142306194) is [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane.
What is the SMILES notation for [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane?
The canonical SMILES for [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane is FC1(P)CC2(CN(c3ccc(-c4ccn5c(-c6ccnc7ccccc67)cnc5c4)cn3)C2)C1.
What is the InChIKey of [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane?
The InChIKey is LPKMDVPCSBFKNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23FN5P/c28-27(34)14-26(15-27)16-32(17-26)24-6-5-19(12-30-24)18-8-10-33-23(13-31-25(33)11-18)21-7-9-29-22-4-2-1-3-20(21)22/h1-13H,14-17,34H2.
What are the key properties of [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane?
[6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane has a molecular weight of 467.49 g/mol, XLogP of 5.75, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-fluoro-2-[5-(3-quinolin-4-ylimidazo[1,2-a]pyridin-7-yl)-2-pyridinyl]-2-azaspiro[3.3]heptan-6-yl]phosphane is sourced from PubChem (CID 142306194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).