[4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine

C15H19FN4O2 — CID 140898054

IUPAC[4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine
SMILESNCc1ccc(COc2n[nH]c(C3CNCCO3)c2F)cc1
InChIInChI=1S/C15H19FN4O2/c16-13-14(12-8-18-5-6-21-12)19-20-15(13)22-9-11-3-1-10(7-17)2-4-11/h1-4,12,18H,5-9,17H2,(H,19,20)
InChIKeyGGJYBCLPLMEPJJ-UHFFFAOYSA-N
MW306.34 g/mol
LogP1.25
Rot. Bonds5

About [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine

[4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine (PubChem CID 140898054) has the molecular formula C15H19FN4O2 and a molecular weight of 306.34 g/mol. Its IUPAC name is [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine.

Molecular Properties

Compound Name[4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine
PubChem CID140898054
Molecular FormulaC15H19FN4O2
Molecular Weight306.34 g/mol
Exact Mass306.15
IUPAC Name[4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine
SMILESNCc1ccc(COc2n[nH]c(C3CNCCO3)c2F)cc1
InChIInChI=1S/C15H19FN4O2/c16-13-14(12-8-18-5-6-21-12)19-20-15(13)22-9-11-3-1-10(7-17)2-4-11/h1-4,12,18H,5-9,17H2,(H,19,20)
InChIKeyGGJYBCLPLMEPJJ-UHFFFAOYSA-N
XLogP1.25
TPSA85.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine 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-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine?
The IUPAC name of [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine (CID 140898054) is [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine.
What is the SMILES notation for [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine?
The canonical SMILES for [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine is NCc1ccc(COc2n[nH]c(C3CNCCO3)c2F)cc1.
What is the InChIKey of [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine?
The InChIKey is GGJYBCLPLMEPJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4O2/c16-13-14(12-8-18-5-6-21-12)19-20-15(13)22-9-11-3-1-10(7-17)2-4-11/h1-4,12,18H,5-9,17H2,(H,19,20).
What are the key properties of [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine?
[4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine has a molecular weight of 306.34 g/mol, XLogP of 1.25, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(4-fluoro-5-morpholin-2-yl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine is sourced from PubChem (CID 140898054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).