[6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone

C25H24N4O4 — CID 71242961

IUPAC[6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(-c2ccc3c(-c4ccc(OCCO)cc4)cnn3c2)nc1)N1CCOCC1
InChIInChI=1S/C25H24N4O4/c30-11-14-33-21-5-1-18(2-6-21)22-16-27-29-17-20(4-8-24(22)29)23-7-3-19(15-26-23)25(31)28-9-12-32-13-10-28/h1-8,15-17,30H,9-14H2
InChIKeyWYUBECAAKYLSMI-UHFFFAOYSA-N
MW444.49 g/mol
LogP2.91
Rot. Bonds6

About [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone

[6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 71242961) has the molecular formula C25H24N4O4 and a molecular weight of 444.49 g/mol. Its IUPAC name is [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone
PubChem CID71242961
Molecular FormulaC25H24N4O4
Molecular Weight444.49 g/mol
Exact Mass444.18
IUPAC Name[6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(-c2ccc3c(-c4ccc(OCCO)cc4)cnn3c2)nc1)N1CCOCC1
InChIInChI=1S/C25H24N4O4/c30-11-14-33-21-5-1-18(2-6-21)22-16-27-29-17-20(4-8-24(22)29)23-7-3-19(15-26-23)25(31)28-9-12-32-13-10-28/h1-8,15-17,30H,9-14H2
InChIKeyWYUBECAAKYLSMI-UHFFFAOYSA-N
XLogP2.91
TPSA89.19 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.49
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone (CID 71242961) is [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone is O=C(c1ccc(-c2ccc3c(-c4ccc(OCCO)cc4)cnn3c2)nc1)N1CCOCC1.
What is the InChIKey of [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is WYUBECAAKYLSMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O4/c30-11-14-33-21-5-1-18(2-6-21)22-16-27-29-17-20(4-8-24(22)29)23-7-3-19(15-26-23)25(31)28-9-12-32-13-10-28/h1-8,15-17,30H,9-14H2.
What are the key properties of [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone?
[6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 444.49 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[3-[4-(2-hydroxyethoxy)phenyl]pyrazolo[1,5-a]pyridin-6-yl]-3-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 71242961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).