(2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine

C14H18FNO — CID 170319461

IUPAC(2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine
SMILESC[C@@]1(c2cccc(C3CC3)c2F)CNCCO1
InChIInChI=1S/C14H18FNO/c1-14(9-16-7-8-17-14)12-4-2-3-11(13(12)15)10-5-6-10/h2-4,10,16H,5-9H2,1H3/t14-/m0/s1
InChIKeyQELPNVAQDLIVOI-AWEZNQCLSA-N
MW235.30 g/mol
LogP2.54
Rot. Bonds2

About (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine

(2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine (PubChem CID 170319461) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine.

Molecular Properties

Compound Name(2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine
PubChem CID170319461
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC Name(2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine
SMILESC[C@@]1(c2cccc(C3CC3)c2F)CNCCO1
InChIInChI=1S/C14H18FNO/c1-14(9-16-7-8-17-14)12-4-2-3-11(13(12)15)10-5-6-10/h2-4,10,16H,5-9H2,1H3/t14-/m0/s1
InChIKeyQELPNVAQDLIVOI-AWEZNQCLSA-N
XLogP2.54
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine?
The IUPAC name of (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine (CID 170319461) is (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine.
What is the SMILES notation for (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine?
The canonical SMILES for (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine is C[C@@]1(c2cccc(C3CC3)c2F)CNCCO1.
What is the InChIKey of (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine?
The InChIKey is QELPNVAQDLIVOI-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H18FNO/c1-14(9-16-7-8-17-14)12-4-2-3-11(13(12)15)10-5-6-10/h2-4,10,16H,5-9H2,1H3/t14-/m0/s1.
What are the key properties of (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine?
(2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine has a molecular weight of 235.30 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-cyclopropyl-2-fluorophenyl)-2-methylmorpholine is sourced from PubChem (CID 170319461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).