4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine

C14H16FN3O — CID 53193284

IUPAC4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine
SMILESFc1cccc(-c2cc(CN3CCOCC3)[nH]n2)c1
InChIInChI=1S/C14H16FN3O/c15-12-3-1-2-11(8-12)14-9-13(16-17-14)10-18-4-6-19-7-5-18/h1-3,8-9H,4-7,10H2,(H,16,17)
InChIKeyMZQKHFPTYSNVFZ-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.05
Rot. Bonds3

About 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine

4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine (PubChem CID 53193284) has the molecular formula C14H16FN3O and a molecular weight of 261.30 g/mol. Its IUPAC name is 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine
PubChem CID53193284
Molecular FormulaC14H16FN3O
Molecular Weight261.30 g/mol
Exact Mass261.13
IUPAC Name4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine
SMILESFc1cccc(-c2cc(CN3CCOCC3)[nH]n2)c1
InChIInChI=1S/C14H16FN3O/c15-12-3-1-2-11(8-12)14-9-13(16-17-14)10-18-4-6-19-7-5-18/h1-3,8-9H,4-7,10H2,(H,16,17)
InChIKeyMZQKHFPTYSNVFZ-UHFFFAOYSA-N
XLogP2.05
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]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-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine?
The IUPAC name of 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine (CID 53193284) is 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine.
What is the SMILES notation for 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine?
The canonical SMILES for 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine is Fc1cccc(-c2cc(CN3CCOCC3)[nH]n2)c1.
What is the InChIKey of 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine?
The InChIKey is MZQKHFPTYSNVFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O/c15-12-3-1-2-11(8-12)14-9-13(16-17-14)10-18-4-6-19-7-5-18/h1-3,8-9H,4-7,10H2,(H,16,17).
What are the key properties of 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine?
4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine has a molecular weight of 261.30 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-(3-fluorophenyl)-1H-pyrazol-5-yl]methyl]morpholine is sourced from PubChem (CID 53193284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).