morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone

C21H23N5O4 — CID 56941932

IUPACmorpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone
SMILESO=C(c1cc(-c2n[nH]c3ccnc(OC4CCOCC4)c23)ccn1)N1CCOCC1
InChIInChI=1S/C21H23N5O4/c27-21(26-7-11-29-12-8-26)17-13-14(1-5-22-17)19-18-16(24-25-19)2-6-23-20(18)30-15-3-9-28-10-4-15/h1-2,5-6,13,15H,3-4,7-12H2,(H,24,25)
InChIKeyUUGUZTUFVNGSHH-UHFFFAOYSA-N
MW409.45 g/mol
LogP2.05
Rot. Bonds4

About morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone

morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone (PubChem CID 56941932) has the molecular formula C21H23N5O4 and a molecular weight of 409.45 g/mol. Its IUPAC name is morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone
PubChem CID56941932
Molecular FormulaC21H23N5O4
Molecular Weight409.45 g/mol
Exact Mass409.18
IUPAC Namemorpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone
SMILESO=C(c1cc(-c2n[nH]c3ccnc(OC4CCOCC4)c23)ccn1)N1CCOCC1
InChIInChI=1S/C21H23N5O4/c27-21(26-7-11-29-12-8-26)17-13-14(1-5-22-17)19-18-16(24-25-19)2-6-23-20(18)30-15-3-9-28-10-4-15/h1-2,5-6,13,15H,3-4,7-12H2,(H,24,25)
InChIKeyUUGUZTUFVNGSHH-UHFFFAOYSA-N
XLogP2.05
TPSA102.46 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.45
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 118381715
CID 118381715
CID 56596227
CID 56596227
CID 56596231
CID 56596231
CID 56941655
CID 56941655
CID 67124352
CID 67124352
CID 86711045
CID 86711045
CID 89777934
CID 89777934
CID 89971850
CID 89971850
CID 90286327
CID 90286327
CID 146254727
CID 146254727
CID 118381130
CID 118381130
CID 46884883
CID 46884883

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone?
The IUPAC name of morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone (CID 56941932) is morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone.
What is the SMILES notation for morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone?
The canonical SMILES for morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone is O=C(c1cc(-c2n[nH]c3ccnc(OC4CCOCC4)c23)ccn1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone?
The InChIKey is UUGUZTUFVNGSHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O4/c27-21(26-7-11-29-12-8-26)17-13-14(1-5-22-17)19-18-16(24-25-19)2-6-23-20(18)30-15-3-9-28-10-4-15/h1-2,5-6,13,15H,3-4,7-12H2,(H,24,25).
What are the key properties of morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone?
morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone has a molecular weight of 409.45 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]methanone is sourced from PubChem (CID 56941932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).