2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone

C19H18ClFN2O3 — CID 165068556

IUPAC2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone
SMILESCOc1c(F)cccc1C(=O)Cc1cn2cc(Cl)nc2cc1OC(C)C
InChIInChI=1S/C19H18ClFN2O3/c1-11(2)26-16-8-18-22-17(20)10-23(18)9-12(16)7-15(24)13-5-4-6-14(21)19(13)25-3/h4-6,8-11H,7H2,1-3H3
InChIKeySJHLKIOBWPWAHF-UHFFFAOYSA-N
MW376.82 g/mol
LogP4.35
Rot. Bonds6

About 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone

2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone (PubChem CID 165068556) has the molecular formula C19H18ClFN2O3 and a molecular weight of 376.82 g/mol. Its IUPAC name is 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone
PubChem CID165068556
Molecular FormulaC19H18ClFN2O3
Molecular Weight376.82 g/mol
Exact Mass376.10
IUPAC Name2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone
SMILESCOc1c(F)cccc1C(=O)Cc1cn2cc(Cl)nc2cc1OC(C)C
InChIInChI=1S/C19H18ClFN2O3/c1-11(2)26-16-8-18-22-17(20)10-23(18)9-12(16)7-15(24)13-5-4-6-14(21)19(13)25-3/h4-6,8-11H,7H2,1-3H3
InChIKeySJHLKIOBWPWAHF-UHFFFAOYSA-N
XLogP4.35
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.82
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone?
The IUPAC name of 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone (CID 165068556) is 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone.
What is the SMILES notation for 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone?
The canonical SMILES for 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone is COc1c(F)cccc1C(=O)Cc1cn2cc(Cl)nc2cc1OC(C)C.
What is the InChIKey of 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone?
The InChIKey is SJHLKIOBWPWAHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClFN2O3/c1-11(2)26-16-8-18-22-17(20)10-23(18)9-12(16)7-15(24)13-5-4-6-14(21)19(13)25-3/h4-6,8-11H,7H2,1-3H3.
What are the key properties of 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone?
2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone has a molecular weight of 376.82 g/mol, XLogP of 4.35, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl)-1-(3-fluoro-2-methoxyphenyl)ethanone is sourced from PubChem (CID 165068556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).