N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide

C22H24F2N4O3 — CID 155438787

IUPACN-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide
SMILESCC(C)Oc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1cccc(C(F)F)n1
InChIInChI=1S/C22H24F2N4O3/c1-13(2)31-18-10-20-26-17(14-6-8-30-9-7-14)12-28(20)11-15(18)22(29)27-19-5-3-4-16(25-19)21(23)24/h3-5,10-14,21H,6-9H2,1-2H3,(H,25,27,29)
InChIKeyOGDQZVQHXVEVAF-UHFFFAOYSA-N
MW430.46 g/mol
LogP4.60
Rot. Bonds6

About N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide

N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 155438787) has the molecular formula C22H24F2N4O3 and a molecular weight of 430.46 g/mol. Its IUPAC name is N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID155438787
Molecular FormulaC22H24F2N4O3
Molecular Weight430.46 g/mol
Exact Mass430.18
IUPAC NameN-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide
SMILESCC(C)Oc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1cccc(C(F)F)n1
InChIInChI=1S/C22H24F2N4O3/c1-13(2)31-18-10-20-26-17(14-6-8-30-9-7-14)12-28(20)11-15(18)22(29)27-19-5-3-4-16(25-19)21(23)24/h3-5,10-14,21H,6-9H2,1-2H3,(H,25,27,29)
InChIKeyOGDQZVQHXVEVAF-UHFFFAOYSA-N
XLogP4.60
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.46
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide (CID 155438787) is N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide is CC(C)Oc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1cccc(C(F)F)n1.
What is the InChIKey of N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is OGDQZVQHXVEVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24F2N4O3/c1-13(2)31-18-10-20-26-17(14-6-8-30-9-7-14)12-28(20)11-15(18)22(29)27-19-5-3-4-16(25-19)21(23)24/h3-5,10-14,21H,6-9H2,1-2H3,(H,25,27,29).
What are the key properties of N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide?
N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 430.46 g/mol, XLogP of 4.60, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(difluoromethyl)-2-pyridinyl]-2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 155438787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).