3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine — IUPAC name, SMILES, InChIKey & properties

Name: 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

About 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine

3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine (PubChem CID 159492007) has the molecular formula C70H59F12N9O5 and a molecular weight of 1334.28 g/mol. Its IUPAC name is 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name	3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine
PubChem CID	159492007
Molecular Formula	C70H59F12N9O5
Molecular Weight	1334.28 g/mol
Exact Mass	1333.44
IUPAC Name	3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine
SMILES	CC(F)(F)c1cnn2ccc(-c3ccc(C4(C#N)CC4)cc3)cc12.COC(C)(C)c1ccc(-c2ccn3ncc(C(C)(F)F)c3c2)cc1.COc1cc(OC(F)(F)F)ccc1-c1ccn2ncc(C(C)(F)F)c2c1.COc1cc(OC(F)(F)F)ccc1-c1ccn2nccc2c1
InChI	InChI=1S/C19H15F2N3.C19H20F2N2O.C17H13F5N2O2.C15H11F3N2O2/c1-18(20,21)16-11-23-24-9-6-14(10-17(16)24)13-2-4-15(5-3-13)19(12-22)7-8-19;1-18(2,24-4)15-7-5-13(6-8-15)14-9-10-23-17(11-14)16(12-22-23)19(3,20)21;1-16(18,19)13-9-23-24-6-5-10(7-14(13)24)12-4-3-11(8-15(12)25-2)26-17(20,21)22;1-21-14-9-12(22-15(16,17)18)2-3-13(14)10-5-7-20-11(8-10)4-6-19-20/h2-6,9-11H,7-8H2,1H3;5-12H,1-4H3;3-9H,1-2H3;2-9H,1H3
InChIKey	LYHQOMBHVIYFLV-UHFFFAOYSA-N
XLogP	18.59
TPSA	139.14 Å²
H-Bond Donors
H-Bond Acceptors	14
Rotatable Bonds	14
Heavy Atoms	96
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1334.28
LogP ≤ 5	18.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Analyze 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine?

The IUPAC name of 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine (CID 159492007) is 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine.

What is the SMILES notation for 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine?

The canonical SMILES for 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine is CC(F)(F)c1cnn2ccc(-c3ccc(C4(C#N)CC4)cc3)cc12.COC(C)(C)c1ccc(-c2ccn3ncc(C(C)(F)F)c3c2)cc1.COc1cc(OC(F)(F)F)ccc1-c1ccn2ncc(C(C)(F)F)c2c1.COc1cc(OC(F)(F)F)ccc1-c1ccn2nccc2c1.

What is the InChIKey of 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine?

The InChIKey is LYHQOMBHVIYFLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N3.C19H20F2N2O.C17H13F5N2O2.C15H11F3N2O2/c1-18(20,21)16-11-23-24-9-6-14(10-17(16)24)13-2-4-15(5-3-13)19(12-22)7-8-19;1-18(2,24-4)15-7-5-13(6-8-15)14-9-10-23-17(11-14)16(12-22-23)19(3,20)21;1-16(18,19)13-9-23-24-6-5-10(7-14(13)24)12-4-3-11(8-15(12)25-2)26-17(20,21)22;1-21-14-9-12(22-15(16,17)18)2-3-13(14)10-5-7-20-11(8-10)4-6-19-20/h2-6,9-11H,7-8H2,1H3;5-12H,1-4H3;3-9H,1-2H3;2-9H,1H3.

What are the key properties of 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine?

Where does this data come from?

All data for 3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyridine;3-(1,1-difluoroethyl)-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyridin-5-yl]phenyl]cyclopropane-1-carbonitrile;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 159492007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).