[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol

C24H23FN4O2 — CID 134211933

IUPAC[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol
SMILESCc1cc(-c2ncccc2-c2ccc3ncc(C(O)N4CCOCC4)n3c2)ccc1F
InChIInChI=1S/C24H23FN4O2/c1-16-13-17(4-6-20(16)25)23-19(3-2-8-26-23)18-5-7-22-27-14-21(29(22)15-18)24(30)28-9-11-31-12-10-28/h2-8,13-15,24,30H,9-12H2,1H3
InChIKeyPMBLBTUTUJCMPN-UHFFFAOYSA-N
MW418.47 g/mol
LogP3.83
Rot. Bonds4

About [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol

[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol (PubChem CID 134211933) has the molecular formula C24H23FN4O2 and a molecular weight of 418.47 g/mol. Its IUPAC name is [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol.

Molecular Properties

Compound Name[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol
PubChem CID134211933
Molecular FormulaC24H23FN4O2
Molecular Weight418.47 g/mol
Exact Mass418.18
IUPAC Name[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol
SMILESCc1cc(-c2ncccc2-c2ccc3ncc(C(O)N4CCOCC4)n3c2)ccc1F
InChIInChI=1S/C24H23FN4O2/c1-16-13-17(4-6-20(16)25)23-19(3-2-8-26-23)18-5-7-22-27-14-21(29(22)15-18)24(30)28-9-11-31-12-10-28/h2-8,13-15,24,30H,9-12H2,1H3
InChIKeyPMBLBTUTUJCMPN-UHFFFAOYSA-N
XLogP3.83
TPSA62.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.47
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol?
The IUPAC name of [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol (CID 134211933) is [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol.
What is the SMILES notation for [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol?
The canonical SMILES for [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol is Cc1cc(-c2ncccc2-c2ccc3ncc(C(O)N4CCOCC4)n3c2)ccc1F.
What is the InChIKey of [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol?
The InChIKey is PMBLBTUTUJCMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN4O2/c1-16-13-17(4-6-20(16)25)23-19(3-2-8-26-23)18-5-7-22-27-14-21(29(22)15-18)24(30)28-9-11-31-12-10-28/h2-8,13-15,24,30H,9-12H2,1H3.
What are the key properties of [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol?
[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol has a molecular weight of 418.47 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanol is sourced from PubChem (CID 134211933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).