4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide

C19H22FN5O — CID 90403283

About 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide

4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide (PubChem CID 90403283) has the molecular formula C19H22FN5O and a molecular weight of 355.42 g/mol. Its IUPAC name is 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide.

Molecular Properties

• Compound Name: 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide
• PubChem CID: 90403283
• Molecular Formula: C19H22FN5O
• Molecular Weight: 355.42 g/mol
• Exact Mass: 355.18
• IUPAC Name: 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide
• SMILES: Cc1cnc2nc(-c3cc(NC(=O)CCCN(C)C)ccc3F)[nH]c2c1
• InChI: InChI=1S/C19H22FN5O/c1-12-9-16-19(21-11-12)24-18(23-16)14-10-13(6-7-15(14)20)22-17(26)5-4-8-25(2)3/h6-7,9-11H,4-5,8H2,1-3H3,(H,22,26)(H,21,23,24)
• InChIKey: OPFZADPUCJDCAX-UHFFFAOYSA-N
• XLogP: 3.35
• TPSA: 73.91 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	355.42
LogP ≤ 5	3.35
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide?

The IUPAC name of 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide (CID 90403283) is 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide.

What is the SMILES notation for 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide?

The canonical SMILES for 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide is Cc1cnc2nc(-c3cc(NC(=O)CCCN(C)C)ccc3F)[nH]c2c1.

What is the InChIKey of 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide?

The InChIKey is OPFZADPUCJDCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN5O/c1-12-9-16-19(21-11-12)24-18(23-16)14-10-13(6-7-15(14)20)22-17(26)5-4-8-25(2)3/h6-7,9-11H,4-5,8H2,1-3H3,(H,22,26)(H,21,23,24).

What are the key properties of 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide?

4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide has a molecular weight of 355.42 g/mol, XLogP of 3.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide is sourced from PubChem (CID 90403283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).