[4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol

C24H27FN4O2 — CID 158500685

IUPAC[4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol
SMILESCCCc1cnc2ccc(-c3cc(F)ccc3OCCc3c(CO)nn(C)c3C)cn12
InChIInChI=1S/C24H27FN4O2/c1-4-5-19-13-26-24-9-6-17(14-29(19)24)21-12-18(25)7-8-23(21)31-11-10-20-16(2)28(3)27-22(20)15-30/h6-9,12-14,30H,4-5,10-11,15H2,1-3H3
InChIKeyGCQJQWLJUOLQRQ-UHFFFAOYSA-N
MW422.50 g/mol
LogP4.25
Rot. Bonds8

About [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol

[4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol (PubChem CID 158500685) has the molecular formula C24H27FN4O2 and a molecular weight of 422.50 g/mol. Its IUPAC name is [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol.

Molecular Properties

Compound Name[4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol
PubChem CID158500685
Molecular FormulaC24H27FN4O2
Molecular Weight422.50 g/mol
Exact Mass422.21
IUPAC Name[4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol
SMILESCCCc1cnc2ccc(-c3cc(F)ccc3OCCc3c(CO)nn(C)c3C)cn12
InChIInChI=1S/C24H27FN4O2/c1-4-5-19-13-26-24-9-6-17(14-29(19)24)21-12-18(25)7-8-23(21)31-11-10-20-16(2)28(3)27-22(20)15-30/h6-9,12-14,30H,4-5,10-11,15H2,1-3H3
InChIKeyGCQJQWLJUOLQRQ-UHFFFAOYSA-N
XLogP4.25
TPSA64.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.50
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol?
The IUPAC name of [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol (CID 158500685) is [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol.
What is the SMILES notation for [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol?
The canonical SMILES for [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol is CCCc1cnc2ccc(-c3cc(F)ccc3OCCc3c(CO)nn(C)c3C)cn12.
What is the InChIKey of [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol?
The InChIKey is GCQJQWLJUOLQRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27FN4O2/c1-4-5-19-13-26-24-9-6-17(14-29(19)24)21-12-18(25)7-8-23(21)31-11-10-20-16(2)28(3)27-22(20)15-30/h6-9,12-14,30H,4-5,10-11,15H2,1-3H3.
What are the key properties of [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol?
[4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol has a molecular weight of 422.50 g/mol, XLogP of 4.25, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-[4-fluoro-2-(3-propylimidazo[1,2-a]pyridin-6-yl)phenoxy]ethyl]-1,5-dimethylpyrazol-3-yl]methanol is sourced from PubChem (CID 158500685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).