[6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone

C18H17FN4O2 — CID 134801542

IUPAC[6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone
SMILESCn1ncc2c(C(=O)N3CCOCC3)cc(-c3cccc(F)c3)nc21
InChIInChI=1S/C18H17FN4O2/c1-22-17-15(11-20-22)14(18(24)23-5-7-25-8-6-23)10-16(21-17)12-3-2-4-13(19)9-12/h2-4,9-11H,5-8H2,1H3
InChIKeyUCBVEWKJTGJYSB-UHFFFAOYSA-N
MW340.36 g/mol
LogP2.25
Rot. Bonds2

About [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone

[6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone (PubChem CID 134801542) has the molecular formula C18H17FN4O2 and a molecular weight of 340.36 g/mol. Its IUPAC name is [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone
PubChem CID134801542
Molecular FormulaC18H17FN4O2
Molecular Weight340.36 g/mol
Exact Mass340.13
IUPAC Name[6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone
SMILESCn1ncc2c(C(=O)N3CCOCC3)cc(-c3cccc(F)c3)nc21
InChIInChI=1S/C18H17FN4O2/c1-22-17-15(11-20-22)14(18(24)23-5-7-25-8-6-23)10-16(21-17)12-3-2-4-13(19)9-12/h2-4,9-11H,5-8H2,1H3
InChIKeyUCBVEWKJTGJYSB-UHFFFAOYSA-N
XLogP2.25
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.36
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone (CID 134801542) is [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone is Cn1ncc2c(C(=O)N3CCOCC3)cc(-c3cccc(F)c3)nc21.
What is the InChIKey of [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is UCBVEWKJTGJYSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O2/c1-22-17-15(11-20-22)14(18(24)23-5-7-25-8-6-23)10-16(21-17)12-3-2-4-13(19)9-12/h2-4,9-11H,5-8H2,1H3.
What are the key properties of [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone?
[6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 340.36 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 134801542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).