(2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine

C19H18FN3O — CID 71656802

IUPAC(2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine
SMILESFc1ccc(-n2cc(-c3ccc([C@@H]4CNCCO4)cc3)cn2)cc1
InChIInChI=1S/C19H18FN3O/c20-17-5-7-18(8-6-17)23-13-16(11-22-23)14-1-3-15(4-2-14)19-12-21-9-10-24-19/h1-8,11,13,19,21H,9-10,12H2/t19-/m0/s1
InChIKeyANIXSCDCEWNQJP-IBGZPJMESA-N
MW323.37 g/mol
LogP3.34
Rot. Bonds3

About (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine

(2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine (PubChem CID 71656802) has the molecular formula C19H18FN3O and a molecular weight of 323.37 g/mol. Its IUPAC name is (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine.

Molecular Properties

Compound Name(2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine
PubChem CID71656802
Molecular FormulaC19H18FN3O
Molecular Weight323.37 g/mol
Exact Mass323.14
IUPAC Name(2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine
SMILESFc1ccc(-n2cc(-c3ccc([C@@H]4CNCCO4)cc3)cn2)cc1
InChIInChI=1S/C19H18FN3O/c20-17-5-7-18(8-6-17)23-13-16(11-22-23)14-1-3-15(4-2-14)19-12-21-9-10-24-19/h1-8,11,13,19,21H,9-10,12H2/t19-/m0/s1
InChIKeyANIXSCDCEWNQJP-IBGZPJMESA-N
XLogP3.34
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.37
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine?
The IUPAC name of (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine (CID 71656802) is (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine.
What is the SMILES notation for (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine?
The canonical SMILES for (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine is Fc1ccc(-n2cc(-c3ccc([C@@H]4CNCCO4)cc3)cn2)cc1.
What is the InChIKey of (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine?
The InChIKey is ANIXSCDCEWNQJP-IBGZPJMESA-N. The full InChI is InChI=1S/C19H18FN3O/c20-17-5-7-18(8-6-17)23-13-16(11-22-23)14-1-3-15(4-2-14)19-12-21-9-10-24-19/h1-8,11,13,19,21H,9-10,12H2/t19-/m0/s1.
What are the key properties of (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine?
(2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine has a molecular weight of 323.37 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine is sourced from PubChem (CID 71656802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).