(3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone

C19H19FN4O — CID 141381358

IUPAC(3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone
SMILESCN1CCN(C(=O)c2ccc(-c3ccc4nccn4c3)c(F)c2)CC1
InChIInChI=1S/C19H19FN4O/c1-22-8-10-23(11-9-22)19(25)14-2-4-16(17(20)12-14)15-3-5-18-21-6-7-24(18)13-15/h2-7,12-13H,8-11H2,1H3
InChIKeyNWKQMRNKXLBPSL-UHFFFAOYSA-N
MW338.39 g/mol
LogP2.53
Rot. Bonds2

About (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone

(3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone (PubChem CID 141381358) has the molecular formula C19H19FN4O and a molecular weight of 338.39 g/mol. Its IUPAC name is (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name(3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone
PubChem CID141381358
Molecular FormulaC19H19FN4O
Molecular Weight338.39 g/mol
Exact Mass338.15
IUPAC Name(3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone
SMILESCN1CCN(C(=O)c2ccc(-c3ccc4nccn4c3)c(F)c2)CC1
InChIInChI=1S/C19H19FN4O/c1-22-8-10-23(11-9-22)19(25)14-2-4-16(17(20)12-14)15-3-5-18-21-6-7-24(18)13-15/h2-7,12-13H,8-11H2,1H3
InChIKeyNWKQMRNKXLBPSL-UHFFFAOYSA-N
XLogP2.53
TPSA40.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

imidazo[1,2-a]pyridin-7-yl-(4-methyl-1,4-diazepan-1-yl)methanone
CID 97237862
azepan-1-yl(imidazo[1,2-a]pyridin-6-yl)methanone
CID 110704027
(4-chloro-3-fluorophenyl)-(4-methylpiperazin-1-yl)methanone
CID 103875464
4-imidazo[1,2-a]pyridin-6-ylbenzoic acid
CID 82063340
imidazo[1,2-a]pyridin-6-yl-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]methanone
CID 56785307
(3-fluoro-4-methoxyphenyl)-[4-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]methanone
CID 122343513
4-[5-[2-fluoro-4-(3-methylimidazolidine-1-carbonyl)phenyl]-2-pyridinyl]-1-hydroxynaphthalene-2-carbaldehyde
CID 167167860
N-[[1-(imidazo[1,2-a]pyridine-6-carbonyl)piperidin-4-yl]methyl]-N,1-dimethylpiperidine-4-carboxamide
CID 167909355
imidazo[1,2-a]pyridin-7-yl(pyrrolidin-1-yl)methanone
CID 118588718
(3-fluoro-4-piperazin-1-ylphenyl)-(4-methylpiperazin-1-yl)methanone
CID 59295895
(4-methylpiperazin-1-yl)-[3-(4-pyridin-2-ylpiperazine-1-carbonyl)phenyl]methanone
CID 109053532
[1-[5-(2-fluorophenyl)pyrimidin-2-yl]-3-methylindol-6-yl]-(4-methylpiperazin-1-yl)methanone
CID 118671727

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone?
The IUPAC name of (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone (CID 141381358) is (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone.
What is the SMILES notation for (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone?
The canonical SMILES for (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone is CN1CCN(C(=O)c2ccc(-c3ccc4nccn4c3)c(F)c2)CC1.
What is the InChIKey of (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone?
The InChIKey is NWKQMRNKXLBPSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O/c1-22-8-10-23(11-9-22)19(25)14-2-4-16(17(20)12-14)15-3-5-18-21-6-7-24(18)13-15/h2-7,12-13H,8-11H2,1H3.
What are the key properties of (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone?
(3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone has a molecular weight of 338.39 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)-(4-methylpiperazin-1-yl)methanone is sourced from PubChem (CID 141381358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).