7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine

C22H28FN3O2 — CID 58764304

IUPAC7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine
SMILESCCc1nn2c(-c3ccc(OC)cc3OC)cccc2c1N(CC)CCCF
InChIInChI=1S/C22H28FN3O2/c1-5-18-22(25(6-2)14-8-13-23)20-10-7-9-19(26(20)24-18)17-12-11-16(27-3)15-21(17)28-4/h7,9-12,15H,5-6,8,13-14H2,1-4H3
InChIKeyTUQZIHQNJRSEDZ-UHFFFAOYSA-N
MW385.48 g/mol
LogP4.77
Rot. Bonds9

About 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine

7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine (PubChem CID 58764304) has the molecular formula C22H28FN3O2 and a molecular weight of 385.48 g/mol. Its IUPAC name is 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine.

Molecular Properties

Compound Name7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine
PubChem CID58764304
Molecular FormulaC22H28FN3O2
Molecular Weight385.48 g/mol
Exact Mass385.22
IUPAC Name7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine
SMILESCCc1nn2c(-c3ccc(OC)cc3OC)cccc2c1N(CC)CCCF
InChIInChI=1S/C22H28FN3O2/c1-5-18-22(25(6-2)14-8-13-23)20-10-7-9-19(26(20)24-18)17-12-11-16(27-3)15-21(17)28-4/h7,9-12,15H,5-6,8,13-14H2,1-4H3
InChIKeyTUQZIHQNJRSEDZ-UHFFFAOYSA-N
XLogP4.77
TPSA39.00 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.48
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine?
The IUPAC name of 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine (CID 58764304) is 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine.
What is the SMILES notation for 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine?
The canonical SMILES for 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine is CCc1nn2c(-c3ccc(OC)cc3OC)cccc2c1N(CC)CCCF.
What is the InChIKey of 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine?
The InChIKey is TUQZIHQNJRSEDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28FN3O2/c1-5-18-22(25(6-2)14-8-13-23)20-10-7-9-19(26(20)24-18)17-12-11-16(27-3)15-21(17)28-4/h7,9-12,15H,5-6,8,13-14H2,1-4H3.
What are the key properties of 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine?
7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine has a molecular weight of 385.48 g/mol, XLogP of 4.77, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,4-dimethoxyphenyl)-N,2-diethyl-N-(3-fluoropropyl)pyrazolo[1,5-a]pyridin-3-amine is sourced from PubChem (CID 58764304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).