6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

C23H26F2N4O2 — CID 154655792

IUPAC6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCC(C)Cc1cc2nc(C3CCOCC3)cn2cc1NC(=O)c1cccc(C(F)F)n1
InChIInChI=1S/C23H26F2N4O2/c1-14(2)10-16-11-21-27-19(15-6-8-31-9-7-15)12-29(21)13-20(16)28-23(30)18-5-3-4-17(26-18)22(24)25/h3-5,11-15,22H,6-10H2,1-2H3,(H,28,30)
InChIKeyJFXXGPJFQHPRGK-UHFFFAOYSA-N
MW428.48 g/mol
LogP5.01
Rot. Bonds6

About 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (PubChem CID 154655792) has the molecular formula C23H26F2N4O2 and a molecular weight of 428.48 g/mol. Its IUPAC name is 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
PubChem CID154655792
Molecular FormulaC23H26F2N4O2
Molecular Weight428.48 g/mol
Exact Mass428.20
IUPAC Name6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCC(C)Cc1cc2nc(C3CCOCC3)cn2cc1NC(=O)c1cccc(C(F)F)n1
InChIInChI=1S/C23H26F2N4O2/c1-14(2)10-16-11-21-27-19(15-6-8-31-9-7-15)12-29(21)13-20(16)28-23(30)18-5-3-4-17(26-18)22(24)25/h3-5,11-15,22H,6-10H2,1-2H3,(H,28,30)
InChIKeyJFXXGPJFQHPRGK-UHFFFAOYSA-N
XLogP5.01
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.48
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The IUPAC name of 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (CID 154655792) is 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is CC(C)Cc1cc2nc(C3CCOCC3)cn2cc1NC(=O)c1cccc(C(F)F)n1.
What is the InChIKey of 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The InChIKey is JFXXGPJFQHPRGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26F2N4O2/c1-14(2)10-16-11-21-27-19(15-6-8-31-9-7-15)12-29(21)13-20(16)28-23(30)18-5-3-4-17(26-18)22(24)25/h3-5,11-15,22H,6-10H2,1-2H3,(H,28,30).
What are the key properties of 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide has a molecular weight of 428.48 g/mol, XLogP of 5.01, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-N-[7-(2-methylpropyl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is sourced from PubChem (CID 154655792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).