4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine

C19H21N5O3 — CID 161477004

IUPAC4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine
SMILESCc1nc(-c2ccnc(-c3cc(OCCN4CCOCC4)ccn3)c2)no1
InChIInChI=1S/C19H21N5O3/c1-14-22-19(23-27-14)15-2-4-20-17(12-15)18-13-16(3-5-21-18)26-11-8-24-6-9-25-10-7-24/h2-5,12-13H,6-11H2,1H3
InChIKeyWDVSAEDDTWCWHC-UHFFFAOYSA-N
MW367.41 g/mol
LogP2.21
Rot. Bonds6

About 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine

4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine (PubChem CID 161477004) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine
PubChem CID161477004
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC Name4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine
SMILESCc1nc(-c2ccnc(-c3cc(OCCN4CCOCC4)ccn3)c2)no1
InChIInChI=1S/C19H21N5O3/c1-14-22-19(23-27-14)15-2-4-20-17(12-15)18-13-16(3-5-21-18)26-11-8-24-6-9-25-10-7-24/h2-5,12-13H,6-11H2,1H3
InChIKeyWDVSAEDDTWCWHC-UHFFFAOYSA-N
XLogP2.21
TPSA86.40 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine?
The IUPAC name of 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine (CID 161477004) is 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine.
What is the SMILES notation for 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine?
The canonical SMILES for 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine is Cc1nc(-c2ccnc(-c3cc(OCCN4CCOCC4)ccn3)c2)no1.
What is the InChIKey of 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine?
The InChIKey is WDVSAEDDTWCWHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-14-22-19(23-27-14)15-2-4-20-17(12-15)18-13-16(3-5-21-18)26-11-8-24-6-9-25-10-7-24/h2-5,12-13H,6-11H2,1H3.
What are the key properties of 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine?
4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine has a molecular weight of 367.41 g/mol, XLogP of 2.21, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]-4-pyridinyl]oxy]ethyl]morpholine is sourced from PubChem (CID 161477004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).