7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide

C17H16F2N4O — CID 121379409

IUPAC7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1c(C)nn2c(OCc3c(F)cccc3F)cc(C)cc12
InChIInChI=1S/C17H16F2N4O/c1-9-6-14-16(17(20)21)10(2)22-23(14)15(7-9)24-8-11-12(18)4-3-5-13(11)19/h3-7H,8H2,1-2H3,(H3,20,21)
InChIKeyKVJILOJJOJCWOJ-UHFFFAOYSA-N
MW330.34 g/mol
LogP3.09
Rot. Bonds4

About 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide

7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide (PubChem CID 121379409) has the molecular formula C17H16F2N4O and a molecular weight of 330.34 g/mol. Its IUPAC name is 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide.

Molecular Properties

Compound Name7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide
PubChem CID121379409
Molecular FormulaC17H16F2N4O
Molecular Weight330.34 g/mol
Exact Mass330.13
IUPAC Name7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1c(C)nn2c(OCc3c(F)cccc3F)cc(C)cc12
InChIInChI=1S/C17H16F2N4O/c1-9-6-14-16(17(20)21)10(2)22-23(14)15(7-9)24-8-11-12(18)4-3-5-13(11)19/h3-7H,8H2,1-2H3,(H3,20,21)
InChIKeyKVJILOJJOJCWOJ-UHFFFAOYSA-N
XLogP3.09
TPSA76.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

4-amino-1-[7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridin-3-yl]-4-methylpentan-1-one
CID 158471196
(3S)-1-[7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridin-3-yl]-4-hydroxy-3-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)butan-1-one
CID 160561732
1-[7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridin-3-yl]-2-(1-methyl-3,4-dihydro-2H-quinolin-4-yl)ethanone
CID 147664055
(3R)-1-[7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridin-3-yl]-4-hydroxy-3-(5-methylfuran-2-yl)butan-1-one
CID 147844433
(2S)-6-[[7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carbonyl]amino]-2-(methylamino)hexanoic acid
CID 130234400
5-[7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridin-3-yl]pyridine-3-carboxylic acid
CID 121386396
methyl 3-[1-[[7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carbonyl]amino]propan-2-yl]benzoate
CID 121445049
4-[2-[7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one
CID 146930452
N-[(3aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrol-4-yl]-7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboxamide
CID 130255987
3-bromo-2-cyclopropyl-7-[(2,6-difluorophenyl)methoxy]-5-methylpyrazolo[1,5-a]pyridine
CID 121379313
7-[(2,6-difluorophenyl)methoxy]-2,5-dimethyl-N'-[2-(2-oxopyrrolidin-1-yl)acetyl]pyrazolo[1,5-a]pyridine-3-carbohydrazide;2,2,2-trifluoroacetic acid
CID 130234406
7-[(2,6-difluorophenyl)methoxy]-2,5-dimethyl-N-(1-methyl-3,4-dihydro-2H-quinolin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid
CID 130234397

Frequently Asked Questions

What is the IUPAC name of 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide?
The IUPAC name of 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide (CID 121379409) is 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide.
What is the SMILES notation for 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide?
The canonical SMILES for 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide is [H]/N=C(\N)c1c(C)nn2c(OCc3c(F)cccc3F)cc(C)cc12.
What is the InChIKey of 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide?
The InChIKey is KVJILOJJOJCWOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F2N4O/c1-9-6-14-16(17(20)21)10(2)22-23(14)15(7-9)24-8-11-12(18)4-3-5-13(11)19/h3-7H,8H2,1-2H3,(H3,20,21).
What are the key properties of 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide?
7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide has a molecular weight of 330.34 g/mol, XLogP of 3.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridine-3-carboximidamide is sourced from PubChem (CID 121379409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).