3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine

C16H19N5O2 — CID 71977914

IUPAC3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine
SMILESCCc1ccc(C2COCCN2c2cc(C)nc3ncnn23)o1
InChIInChI=1S/C16H19N5O2/c1-3-12-4-5-14(23-12)13-9-22-7-6-20(13)15-8-11(2)19-16-17-10-18-21(15)16/h4-5,8,10,13H,3,6-7,9H2,1-2H3
InChIKeyJBRXNXNUPDAGDO-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.17
Rot. Bonds3

About 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine

3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine (PubChem CID 71977914) has the molecular formula C16H19N5O2 and a molecular weight of 313.36 g/mol. Its IUPAC name is 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine.

Molecular Properties

Compound Name3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine
PubChem CID71977914
Molecular FormulaC16H19N5O2
Molecular Weight313.36 g/mol
Exact Mass313.15
IUPAC Name3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine
SMILESCCc1ccc(C2COCCN2c2cc(C)nc3ncnn23)o1
InChIInChI=1S/C16H19N5O2/c1-3-12-4-5-14(23-12)13-9-22-7-6-20(13)15-8-11(2)19-16-17-10-18-21(15)16/h4-5,8,10,13H,3,6-7,9H2,1-2H3
InChIKeyJBRXNXNUPDAGDO-UHFFFAOYSA-N
XLogP2.17
TPSA68.69 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine?
The IUPAC name of 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine (CID 71977914) is 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine.
What is the SMILES notation for 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine?
The canonical SMILES for 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine is CCc1ccc(C2COCCN2c2cc(C)nc3ncnn23)o1.
What is the InChIKey of 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine?
The InChIKey is JBRXNXNUPDAGDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O2/c1-3-12-4-5-14(23-12)13-9-22-7-6-20(13)15-8-11(2)19-16-17-10-18-21(15)16/h4-5,8,10,13H,3,6-7,9H2,1-2H3.
What are the key properties of 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine?
3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine has a molecular weight of 313.36 g/mol, XLogP of 2.17, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethylfuran-2-yl)-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine is sourced from PubChem (CID 71977914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).