2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide

C19H16FN5O — CID 71084294

IUPAC2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide
SMILESCNC(=O)c1ccc(-c2cnc3ccc(-c4cnn(C)c4)cn23)cc1F
InChIInChI=1S/C19H16FN5O/c1-21-19(26)15-5-3-12(7-16(15)20)17-9-22-18-6-4-13(11-25(17)18)14-8-23-24(2)10-14/h3-11H,1-2H3,(H,21,26)
InChIKeyCOABBEVEJKUKIG-UHFFFAOYSA-N
MW349.37 g/mol
LogP2.90
Rot. Bonds3

About 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide

2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide (PubChem CID 71084294) has the molecular formula C19H16FN5O and a molecular weight of 349.37 g/mol. Its IUPAC name is 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide
PubChem CID71084294
Molecular FormulaC19H16FN5O
Molecular Weight349.37 g/mol
Exact Mass349.13
IUPAC Name2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide
SMILESCNC(=O)c1ccc(-c2cnc3ccc(-c4cnn(C)c4)cn23)cc1F
InChIInChI=1S/C19H16FN5O/c1-21-19(26)15-5-3-12(7-16(15)20)17-9-22-18-6-4-13(11-25(17)18)14-8-23-24(2)10-14/h3-11H,1-2H3,(H,21,26)
InChIKeyCOABBEVEJKUKIG-UHFFFAOYSA-N
XLogP2.90
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.37
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide?
The IUPAC name of 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide (CID 71084294) is 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide.
What is the SMILES notation for 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide?
The canonical SMILES for 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide is CNC(=O)c1ccc(-c2cnc3ccc(-c4cnn(C)c4)cn23)cc1F.
What is the InChIKey of 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide?
The InChIKey is COABBEVEJKUKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5O/c1-21-19(26)15-5-3-12(7-16(15)20)17-9-22-18-6-4-13(11-25(17)18)14-8-23-24(2)10-14/h3-11H,1-2H3,(H,21,26).
What are the key properties of 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide?
2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide has a molecular weight of 349.37 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methyl-4-[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]benzamide is sourced from PubChem (CID 71084294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).