3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol

C9H16F3NO — CID 83960338

IUPAC3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
SMILESCCNCC1CCC(O)(C(F)(F)F)C1
InChIInChI=1S/C9H16F3NO/c1-2-13-6-7-3-4-8(14,5-7)9(10,11)12/h7,13-14H,2-6H2,1H3
InChIKeyUJZCMHXNXKBYIZ-UHFFFAOYSA-N
MW211.23 g/mol
LogP1.69
Rot. Bonds3

About 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol

3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol (PubChem CID 83960338) has the molecular formula C9H16F3NO and a molecular weight of 211.23 g/mol. Its IUPAC name is 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol.

Molecular Properties

Compound Name3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
PubChem CID83960338
Molecular FormulaC9H16F3NO
Molecular Weight211.23 g/mol
Exact Mass211.12
IUPAC Name3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
SMILESCCNCC1CCC(O)(C(F)(F)F)C1
InChIInChI=1S/C9H16F3NO/c1-2-13-6-7-3-4-8(14,5-7)9(10,11)12/h7,13-14H,2-6H2,1H3
InChIKeyUJZCMHXNXKBYIZ-UHFFFAOYSA-N
XLogP1.69
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.23
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1S,2R)-2-(2-methylpropylamino)-1-(trifluoromethyl)cyclopentan-1-ol
CID 167273949
3-(Methylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
CID 83915840
3-Ethyl-3-(methylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
CID 83960325
3-Ethyl-3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
CID 83960326
3-Ethyl-3-(propylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
CID 83960327
3-(Piperazin-1-ylmethyl)-1-(trifluoromethyl)cyclopentan-1-ol
CID 83960337
3-(Propylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
CID 83960339
3-Methyl-3-(methylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
CID 83960349
3-(Ethylaminomethyl)-3-methyl-1-(trifluoromethyl)cyclopentan-1-ol
CID 83960350
3-Methyl-3-(propylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
CID 83960351
3-[2-(Methylamino)ethyl]-1-(trifluoromethyl)cyclopentan-1-ol
CID 84734516
3-[3-(Methylamino)propyl]-1-(trifluoromethyl)cyclopentan-1-ol
CID 84735631

Frequently Asked Questions

What is the IUPAC name of 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol?
The IUPAC name of 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol (CID 83960338) is 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol.
What is the SMILES notation for 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol?
The canonical SMILES for 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol is CCNCC1CCC(O)(C(F)(F)F)C1.
What is the InChIKey of 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol?
The InChIKey is UJZCMHXNXKBYIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3NO/c1-2-13-6-7-3-4-8(14,5-7)9(10,11)12/h7,13-14H,2-6H2,1H3.
What are the key properties of 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol?
3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol has a molecular weight of 211.23 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylaminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol is sourced from PubChem (CID 83960338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).