6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

C19H20F2N4O3 — CID 154655488

IUPAC6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCOCCCc1cn2cc(NC(=O)c3cccc(C(F)F)n3)cc(OC)c2n1
InChIInChI=1S/C19H20F2N4O3/c1-27-8-4-5-12-10-25-11-13(9-16(28-2)18(25)22-12)23-19(26)15-7-3-6-14(24-15)17(20)21/h3,6-7,9-11,17H,4-5,8H2,1-2H3,(H,23,26)
InChIKeySPBRDPIZFOZYCE-UHFFFAOYSA-N
MW390.39 g/mol
LogP3.51
Rot. Bonds8

About 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (PubChem CID 154655488) has the molecular formula C19H20F2N4O3 and a molecular weight of 390.39 g/mol. Its IUPAC name is 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
PubChem CID154655488
Molecular FormulaC19H20F2N4O3
Molecular Weight390.39 g/mol
Exact Mass390.15
IUPAC Name6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCOCCCc1cn2cc(NC(=O)c3cccc(C(F)F)n3)cc(OC)c2n1
InChIInChI=1S/C19H20F2N4O3/c1-27-8-4-5-12-10-25-11-13(9-16(28-2)18(25)22-12)23-19(26)15-7-3-6-14(24-15)17(20)21/h3,6-7,9-11,17H,4-5,8H2,1-2H3,(H,23,26)
InChIKeySPBRDPIZFOZYCE-UHFFFAOYSA-N
XLogP3.51
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.39
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The IUPAC name of 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (CID 154655488) is 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is COCCCc1cn2cc(NC(=O)c3cccc(C(F)F)n3)cc(OC)c2n1.
What is the InChIKey of 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The InChIKey is SPBRDPIZFOZYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F2N4O3/c1-27-8-4-5-12-10-25-11-13(9-16(28-2)18(25)22-12)23-19(26)15-7-3-6-14(24-15)17(20)21/h3,6-7,9-11,17H,4-5,8H2,1-2H3,(H,23,26).
What are the key properties of 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide has a molecular weight of 390.39 g/mol, XLogP of 3.51, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-N-[8-methoxy-2-(3-methoxypropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is sourced from PubChem (CID 154655488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).