(3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone

C17H14ClFN2O2 — CID 126687614

IUPAC(3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone
SMILESCCc1nc2ccc(F)cn2c1C(=O)c1cc(C)c(O)c(Cl)c1
InChIInChI=1S/C17H14ClFN2O2/c1-3-13-15(21-8-11(19)4-5-14(21)20-13)17(23)10-6-9(2)16(22)12(18)7-10/h4-8,22H,3H2,1-2H3
InChIKeyIYCYEONTIAEHRR-UHFFFAOYSA-N
MW332.76 g/mol
LogP3.93
Rot. Bonds3

About (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone

(3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone (PubChem CID 126687614) has the molecular formula C17H14ClFN2O2 and a molecular weight of 332.76 g/mol. Its IUPAC name is (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone.

Molecular Properties

Compound Name(3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone
PubChem CID126687614
Molecular FormulaC17H14ClFN2O2
Molecular Weight332.76 g/mol
Exact Mass332.07
IUPAC Name(3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone
SMILESCCc1nc2ccc(F)cn2c1C(=O)c1cc(C)c(O)c(Cl)c1
InChIInChI=1S/C17H14ClFN2O2/c1-3-13-15(21-8-11(19)4-5-14(21)20-13)17(23)10-6-9(2)16(22)12(18)7-10/h4-8,22H,3H2,1-2H3
InChIKeyIYCYEONTIAEHRR-UHFFFAOYSA-N
XLogP3.93
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.76
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone with MolForge

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Related Compounds

Aminoimidazo[1,2-a]pyridine deriv. 21
CID 5330639
Lingdolinurad
CID 126687506
5-(6-Chloroimidazo[1,2-a]pyridin-2-yl)-2-hydroxybenzamide
CID 134142195
(2-Ethylimidazo[1,2-a]pyridin-3-yl)-(4-hydroxyphenyl)methanone
CID 455752
(2-Ethylimidazo[1,2-a]pyridin-3-yl)-(3-hydroxyphenyl)methanone
CID 455753
2-(4-Chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile
CID 135032509
(3-Chloro-4-methoxyphenyl)(imidazo[1,2-a]pyridin-3-yl)methanone
CID 7150868
(3,5-Dichloro-2-hydroxyphenyl)-(2,3-dimethylimidazo[4,5-b]pyridin-6-yl)methanone
CID 125511267
(3,5-Dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone
CID 134833710
1-(4-Hydroxyphenyl)-2-imidazo[1,2-a]pyridin-3-ylethane-1,2-dione
CID 134956705
5-(2-Ethylimidazo[1,2-a]pyridine-3-carbonyl)-3-fluoro-2-hydroxybenzonitrile
CID 126687479
(3-Bromo-5-fluoro-4-hydroxyphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone
CID 126687501

Frequently Asked Questions

What is the IUPAC name of (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone?
The IUPAC name of (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone (CID 126687614) is (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone.
What is the SMILES notation for (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone?
The canonical SMILES for (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone is CCc1nc2ccc(F)cn2c1C(=O)c1cc(C)c(O)c(Cl)c1.
What is the InChIKey of (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone?
The InChIKey is IYCYEONTIAEHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClFN2O2/c1-3-13-15(21-8-11(19)4-5-14(21)20-13)17(23)10-6-9(2)16(22)12(18)7-10/h4-8,22H,3H2,1-2H3.
What are the key properties of (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone?
(3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone has a molecular weight of 332.76 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-4-hydroxy-5-methylphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanone is sourced from PubChem (CID 126687614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).