6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide

C15H16F2N4O2 — CID 136565181

IUPAC6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCc1cnc2n1CCCC2)c1ccc(OC(F)F)nc1
InChIInChI=1S/C15H16F2N4O2/c16-15(17)23-13-5-4-10(7-19-13)14(22)20-9-11-8-18-12-3-1-2-6-21(11)12/h4-5,7-8,15H,1-3,6,9H2,(H,20,22)
InChIKeySHOKDIVFLCQGRJ-UHFFFAOYSA-N
MW322.31 g/mol
LogP2.15
Rot. Bonds5

About 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide

6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 136565181) has the molecular formula C15H16F2N4O2 and a molecular weight of 322.31 g/mol. Its IUPAC name is 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide
PubChem CID136565181
Molecular FormulaC15H16F2N4O2
Molecular Weight322.31 g/mol
Exact Mass322.12
IUPAC Name6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCc1cnc2n1CCCC2)c1ccc(OC(F)F)nc1
InChIInChI=1S/C15H16F2N4O2/c16-15(17)23-13-5-4-10(7-19-13)14(22)20-9-11-8-18-12-3-1-2-6-21(11)12/h4-5,7-8,15H,1-3,6,9H2,(H,20,22)
InChIKeySHOKDIVFLCQGRJ-UHFFFAOYSA-N
XLogP2.15
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.31
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide (CID 136565181) is 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide is O=C(NCc1cnc2n1CCCC2)c1ccc(OC(F)F)nc1.
What is the InChIKey of 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is SHOKDIVFLCQGRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N4O2/c16-15(17)23-13-5-4-10(7-19-13)14(22)20-9-11-8-18-12-3-1-2-6-21(11)12/h4-5,7-8,15H,1-3,6,9H2,(H,20,22).
What are the key properties of 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide?
6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 322.31 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 136565181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).