4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine

C14H18N4O — CID 50852614

IUPAC4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine
SMILESc1ccc(-c2cn(CCN3CCOCC3)nn2)cc1
InChIInChI=1S/C14H18N4O/c1-2-4-13(5-3-1)14-12-18(16-15-14)7-6-17-8-10-19-11-9-17/h1-5,12H,6-11H2
InChIKeyUEXALPZUYQRYAO-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.28
Rot. Bonds4

About 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine

4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine (PubChem CID 50852614) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine
PubChem CID50852614
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine
SMILESc1ccc(-c2cn(CCN3CCOCC3)nn2)cc1
InChIInChI=1S/C14H18N4O/c1-2-4-13(5-3-1)14-12-18(16-15-14)7-6-17-8-10-19-11-9-17/h1-5,12H,6-11H2
InChIKeyUEXALPZUYQRYAO-UHFFFAOYSA-N
XLogP1.28
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[2-(4-phenyltriazol-1-yl)ethyl]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 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine (CID 50852614) is 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine is c1ccc(-c2cn(CCN3CCOCC3)nn2)cc1.
What is the InChIKey of 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine?
The InChIKey is UEXALPZUYQRYAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-2-4-13(5-3-1)14-12-18(16-15-14)7-6-17-8-10-19-11-9-17/h1-5,12H,6-11H2.
What are the key properties of 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine?
4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine has a molecular weight of 258.32 g/mol, XLogP of 1.28, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-phenyltriazol-1-yl)ethyl]morpholine is sourced from PubChem (CID 50852614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).