3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine

C19H16F2N6 — CID 151866830

IUPAC3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine
SMILESCC(F)c1ncc(-c2nn(Cc3ccccc3F)c3ncccc23)nc1N
InChIInChI=1S/C19H16F2N6/c1-11(20)16-18(22)25-15(9-24-16)17-13-6-4-8-23-19(13)27(26-17)10-12-5-2-3-7-14(12)21/h2-9,11H,10H2,1H3,(H2,22,25)
InChIKeySLVSSYLTUPCZRS-UHFFFAOYSA-N
MW366.38 g/mol
LogP3.69
Rot. Bonds4

About 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine

3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine (PubChem CID 151866830) has the molecular formula C19H16F2N6 and a molecular weight of 366.38 g/mol. Its IUPAC name is 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine.

Molecular Properties

Compound Name3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine
PubChem CID151866830
Molecular FormulaC19H16F2N6
Molecular Weight366.38 g/mol
Exact Mass366.14
IUPAC Name3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine
SMILESCC(F)c1ncc(-c2nn(Cc3ccccc3F)c3ncccc23)nc1N
InChIInChI=1S/C19H16F2N6/c1-11(20)16-18(22)25-15(9-24-16)17-13-6-4-8-23-19(13)27(26-17)10-12-5-2-3-7-14(12)21/h2-9,11H,10H2,1H3,(H2,22,25)
InChIKeySLVSSYLTUPCZRS-UHFFFAOYSA-N
XLogP3.69
TPSA82.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.38
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(1-fluoroethyl)-3-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,2,4-triazin-5-amine
CID 71612612
2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-5-(1-methylsulfinylethyl)pyrimidine-4,6-diamine
CID 157098050
2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-5-N-methylpyrimidine-4,5,6-triamine
CID 131874918
5-(cyclopropylmethyl)-2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrimidin-4-amine
CID 137444694
5-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-2H-triazolo[4,5-d]pyrimidin-7-amine
CID 66613971
5-N-cyclopropyl-2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-5-N-methylpyrimidine-4,5,6-triamine
CID 163681818
3-[4,6-diamino-5-(sulfinamoylamino)pyrimidin-2-yl]-1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine
CID 130245216
methyl N-[4,6-diamino-2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrimidin-5-yl]-N-(trideuterio(113C)methyl)carbamate
CID 76974688
4-amino-6-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrimidine-5-carboxylic acid
CID 123321161
5-N-cyclobutyl-2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrimidine-4,5,6-triamine
CID 66635083
ethyl 5,6-diamino-2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrimidine-4-carboxylate
CID 66614118
4-(difluoromethyl)-5-ethyl-2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-1H-pyrimidin-6-one
CID 137082204

Frequently Asked Questions

What is the IUPAC name of 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine?
The IUPAC name of 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine (CID 151866830) is 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine.
What is the SMILES notation for 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine?
The canonical SMILES for 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine is CC(F)c1ncc(-c2nn(Cc3ccccc3F)c3ncccc23)nc1N.
What is the InChIKey of 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine?
The InChIKey is SLVSSYLTUPCZRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N6/c1-11(20)16-18(22)25-15(9-24-16)17-13-6-4-8-23-19(13)27(26-17)10-12-5-2-3-7-14(12)21/h2-9,11H,10H2,1H3,(H2,22,25).
What are the key properties of 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine?
3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine has a molecular weight of 366.38 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-fluoroethyl)-6-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrazin-2-amine is sourced from PubChem (CID 151866830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).