(2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine

C10H16F3NO — CID 95970473

IUPAC(2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine
SMILESFC(F)(F)[C@@H]1CNC[C@H](C2CCCC2)O1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9-6-14-5-8(15-9)7-3-1-2-4-7/h7-9,14H,1-6H2/t8-,9+/m1/s1
InChIKeyPQRFYIAFENWTLV-BDAKNGLRSA-N
MW223.24 g/mol
LogP2.10
Rot. Bonds1

About (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine

(2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine (PubChem CID 95970473) has the molecular formula C10H16F3NO and a molecular weight of 223.24 g/mol. Its IUPAC name is (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine.

Molecular Properties

Compound Name(2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine
PubChem CID95970473
Molecular FormulaC10H16F3NO
Molecular Weight223.24 g/mol
Exact Mass223.12
IUPAC Name(2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine
SMILESFC(F)(F)[C@@H]1CNC[C@H](C2CCCC2)O1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9-6-14-5-8(15-9)7-3-1-2-4-7/h7-9,14H,1-6H2/t8-,9+/m1/s1
InChIKeyPQRFYIAFENWTLV-BDAKNGLRSA-N
XLogP2.10
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine?
The IUPAC name of (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine (CID 95970473) is (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine.
What is the SMILES notation for (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine?
The canonical SMILES for (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine is FC(F)(F)[C@@H]1CNC[C@H](C2CCCC2)O1.
What is the InChIKey of (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine?
The InChIKey is PQRFYIAFENWTLV-BDAKNGLRSA-N. The full InChI is InChI=1S/C10H16F3NO/c11-10(12,13)9-6-14-5-8(15-9)7-3-1-2-4-7/h7-9,14H,1-6H2/t8-,9+/m1/s1.
What are the key properties of (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine?
(2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine has a molecular weight of 223.24 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,6S)-2-cyclopentyl-6-(trifluoromethyl)morpholine is sourced from PubChem (CID 95970473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).