4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine

C10H16F3NO — CID 129298915

IUPAC4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine
SMILESFC(F)(F)[C@H]1C[C@@H]1COC1CCNCC1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9-5-7(9)6-15-8-1-3-14-4-2-8/h7-9,14H,1-6H2/t7-,9+/m1/s1
InChIKeyGCUCIROCAPCZFK-APPZFPTMSA-N
MW223.24 g/mol
LogP1.95
Rot. Bonds3

About 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine

4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine (PubChem CID 129298915) has the molecular formula C10H16F3NO and a molecular weight of 223.24 g/mol. Its IUPAC name is 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine.

Molecular Properties

Compound Name4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine
PubChem CID129298915
Molecular FormulaC10H16F3NO
Molecular Weight223.24 g/mol
Exact Mass223.12
IUPAC Name4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine
SMILESFC(F)(F)[C@H]1C[C@@H]1COC1CCNCC1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9-5-7(9)6-15-8-1-3-14-4-2-8/h7-9,14H,1-6H2/t7-,9+/m1/s1
InChIKeyGCUCIROCAPCZFK-APPZFPTMSA-N
XLogP1.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine?
The IUPAC name of 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine (CID 129298915) is 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine.
What is the SMILES notation for 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine?
The canonical SMILES for 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine is FC(F)(F)[C@H]1C[C@@H]1COC1CCNCC1.
What is the InChIKey of 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine?
The InChIKey is GCUCIROCAPCZFK-APPZFPTMSA-N. The full InChI is InChI=1S/C10H16F3NO/c11-10(12,13)9-5-7(9)6-15-8-1-3-14-4-2-8/h7-9,14H,1-6H2/t7-,9+/m1/s1.
What are the key properties of 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine?
4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine has a molecular weight of 223.24 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine is sourced from PubChem (CID 129298915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).