4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine

C19H22N4O2 — CID 90400979

IUPAC4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine
SMILESCC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCOCC4)c3)c2c1
InChIInChI=1S/C19H22N4O2/c1-13(2)25-15-3-4-17-16(12-15)19(22-21-17)14-5-6-20-18(11-14)23-7-9-24-10-8-23/h3-6,11-13H,7-10H2,1-2H3,(H,21,22)
InChIKeyBGTSLFFCVKEYPT-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.25
Rot. Bonds4

About 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine

4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine (PubChem CID 90400979) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine
PubChem CID90400979
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine
SMILESCC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCOCC4)c3)c2c1
InChIInChI=1S/C19H22N4O2/c1-13(2)25-15-3-4-17-16(12-15)19(22-21-17)14-5-6-20-18(11-14)23-7-9-24-10-8-23/h3-6,11-13H,7-10H2,1-2H3,(H,21,22)
InChIKeyBGTSLFFCVKEYPT-UHFFFAOYSA-N
XLogP3.25
TPSA63.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine?
The IUPAC name of 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine (CID 90400979) is 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine?
The canonical SMILES for 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine is CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4CCOCC4)c3)c2c1.
What is the InChIKey of 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine?
The InChIKey is BGTSLFFCVKEYPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-13(2)25-15-3-4-17-16(12-15)19(22-21-17)14-5-6-20-18(11-14)23-7-9-24-10-8-23/h3-6,11-13H,7-10H2,1-2H3,(H,21,22).
What are the key properties of 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine?
4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine has a molecular weight of 338.41 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]morpholine is sourced from PubChem (CID 90400979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).