4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine

C26H30N8O — CID 138686577

IUPAC4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine
SMILESCc1cc(-c2[nH]c3ccc(-c4cnn(CCN5CCOCC5)c4)nc3c2C(C)C)cn2ncnc12
InChIInChI=1S/C26H30N8O/c1-17(2)23-24(19-12-18(3)26-27-16-29-34(26)15-19)31-22-5-4-21(30-25(22)23)20-13-28-33(14-20)7-6-32-8-10-35-11-9-32/h4-5,12-17,31H,6-11H2,1-3H3
InChIKeyRVWWBIZWLYHZBZ-UHFFFAOYSA-N
MW470.58 g/mol
LogP3.90
Rot. Bonds6

About 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine

4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine (PubChem CID 138686577) has the molecular formula C26H30N8O and a molecular weight of 470.58 g/mol. Its IUPAC name is 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine
PubChem CID138686577
Molecular FormulaC26H30N8O
Molecular Weight470.58 g/mol
Exact Mass470.25
IUPAC Name4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine
SMILESCc1cc(-c2[nH]c3ccc(-c4cnn(CCN5CCOCC5)c4)nc3c2C(C)C)cn2ncnc12
InChIInChI=1S/C26H30N8O/c1-17(2)23-24(19-12-18(3)26-27-16-29-34(26)15-19)31-22-5-4-21(30-25(22)23)20-13-28-33(14-20)7-6-32-8-10-35-11-9-32/h4-5,12-17,31H,6-11H2,1-3H3
InChIKeyRVWWBIZWLYHZBZ-UHFFFAOYSA-N
XLogP3.90
TPSA89.16 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.58
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine with MolForge

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Related Compounds

CID 118023034
CID 118023034
CID 54766013
CID 54766013
CID 59473233
CID 59473233
CID 118869362
CID 118869362
CID 56927660
CID 56927660
CID 51352628
CID 51352628
CID 9953906
CID 9953906
CID 60148794
CID 60148794
CID 60148924
CID 60148924
CID 73504719
CID 73504719
CID 155925935
CID 155925935
CID 25218685
CID 25218685

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine?
The IUPAC name of 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine (CID 138686577) is 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine.
What is the SMILES notation for 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine?
The canonical SMILES for 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine is Cc1cc(-c2[nH]c3ccc(-c4cnn(CCN5CCOCC5)c4)nc3c2C(C)C)cn2ncnc12.
What is the InChIKey of 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine?
The InChIKey is RVWWBIZWLYHZBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N8O/c1-17(2)23-24(19-12-18(3)26-27-16-29-34(26)15-19)31-22-5-4-21(30-25(22)23)20-13-28-33(14-20)7-6-32-8-10-35-11-9-32/h4-5,12-17,31H,6-11H2,1-3H3.
What are the key properties of 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine?
4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine has a molecular weight of 470.58 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]pyrazol-1-yl]ethyl]morpholine is sourced from PubChem (CID 138686577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).