(2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine

C17H17F2NO — CID 70335756

IUPAC(2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine
SMILESFc1ccc(C(c2ccccc2)[C@@H]2CNCCO2)c(F)c1
InChIInChI=1S/C17H17F2NO/c18-13-6-7-14(15(19)10-13)17(12-4-2-1-3-5-12)16-11-20-8-9-21-16/h1-7,10,16-17,20H,8-9,11H2/t16-,17?/m0/s1
InChIKeyJGZAZKAKOJMOEA-BHWOMJMDSA-N
MW289.32 g/mol
LogP3.09
Rot. Bonds3

About (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine

(2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine (PubChem CID 70335756) has the molecular formula C17H17F2NO and a molecular weight of 289.32 g/mol. Its IUPAC name is (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine.

Molecular Properties

Compound Name(2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine
PubChem CID70335756
Molecular FormulaC17H17F2NO
Molecular Weight289.32 g/mol
Exact Mass289.13
IUPAC Name(2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine
SMILESFc1ccc(C(c2ccccc2)[C@@H]2CNCCO2)c(F)c1
InChIInChI=1S/C17H17F2NO/c18-13-6-7-14(15(19)10-13)17(12-4-2-1-3-5-12)16-11-20-8-9-21-16/h1-7,10,16-17,20H,8-9,11H2/t16-,17?/m0/s1
InChIKeyJGZAZKAKOJMOEA-BHWOMJMDSA-N
XLogP3.09
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.32
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine?
The IUPAC name of (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine (CID 70335756) is (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine.
What is the SMILES notation for (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine?
The canonical SMILES for (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine is Fc1ccc(C(c2ccccc2)[C@@H]2CNCCO2)c(F)c1.
What is the InChIKey of (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine?
The InChIKey is JGZAZKAKOJMOEA-BHWOMJMDSA-N. The full InChI is InChI=1S/C17H17F2NO/c18-13-6-7-14(15(19)10-13)17(12-4-2-1-3-5-12)16-11-20-8-9-21-16/h1-7,10,16-17,20H,8-9,11H2/t16-,17?/m0/s1.
What are the key properties of (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine?
(2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine has a molecular weight of 289.32 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2,4-difluorophenyl)-phenylmethyl]morpholine is sourced from PubChem (CID 70335756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).