6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

C20H20F2N4O3 — CID 154655494

IUPAC6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCOc1cc(NC(=O)c2cccc(C(F)F)n2)cn2cc(C3CCOCC3)nc12
InChIInChI=1S/C20H20F2N4O3/c1-28-17-9-13(23-20(27)15-4-2-3-14(24-15)18(21)22)10-26-11-16(25-19(17)26)12-5-7-29-8-6-12/h2-4,9-12,18H,5-8H2,1H3,(H,23,27)
InChIKeyAXOUDGOPXRYXRB-UHFFFAOYSA-N
MW402.40 g/mol
LogP3.82
Rot. Bonds5

About 6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (PubChem CID 154655494) has the molecular formula C20H20F2N4O3 and a molecular weight of 402.40 g/mol. Its IUPAC name is 6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
PubChem CID154655494
Molecular FormulaC20H20F2N4O3
Molecular Weight402.40 g/mol
Exact Mass402.15
IUPAC Name6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCOc1cc(NC(=O)c2cccc(C(F)F)n2)cn2cc(C3CCOCC3)nc12
InChIInChI=1S/C20H20F2N4O3/c1-28-17-9-13(23-20(27)15-4-2-3-14(24-15)18(21)22)10-26-11-16(25-19(17)26)12-5-7-29-8-6-12/h2-4,9-12,18H,5-8H2,1H3,(H,23,27)
InChIKeyAXOUDGOPXRYXRB-UHFFFAOYSA-N
XLogP3.82
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.40
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The IUPAC name of 6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (CID 154655494) is 6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is COc1cc(NC(=O)c2cccc(C(F)F)n2)cn2cc(C3CCOCC3)nc12.
What is the InChIKey of 6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The InChIKey is AXOUDGOPXRYXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N4O3/c1-28-17-9-13(23-20(27)15-4-2-3-14(24-15)18(21)22)10-26-11-16(25-19(17)26)12-5-7-29-8-6-12/h2-4,9-12,18H,5-8H2,1H3,(H,23,27).
What are the key properties of 6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
6-(difluoromethyl)-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide has a molecular weight of 402.40 g/mol, XLogP of 3.82, 5 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-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is sourced from PubChem (CID 154655494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).