2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine

C14H25F3N2 — CID 79565712

IUPAC2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine
SMILESCCNC1CCCC1CCN(CC(F)(F)F)C1CC1
InChIInChI=1S/C14H25F3N2/c1-2-18-13-5-3-4-11(13)8-9-19(12-6-7-12)10-14(15,16)17/h11-13,18H,2-10H2,1H3
InChIKeyXXUCSUFJHMRPAZ-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.18
Rot. Bonds7

About 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine

2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine (PubChem CID 79565712) has the molecular formula C14H25F3N2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine
PubChem CID79565712
Molecular FormulaC14H25F3N2
Molecular Weight278.36 g/mol
Exact Mass278.20
IUPAC Name2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine
SMILESCCNC1CCCC1CCN(CC(F)(F)F)C1CC1
InChIInChI=1S/C14H25F3N2/c1-2-18-13-5-3-4-11(13)8-9-19(12-6-7-12)10-14(15,16)17/h11-13,18H,2-10H2,1H3
InChIKeyXXUCSUFJHMRPAZ-UHFFFAOYSA-N
XLogP3.18
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine?
The IUPAC name of 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine (CID 79565712) is 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine.
What is the SMILES notation for 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine?
The canonical SMILES for 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine is CCNC1CCCC1CCN(CC(F)(F)F)C1CC1.
What is the InChIKey of 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine?
The InChIKey is XXUCSUFJHMRPAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2/c1-2-18-13-5-3-4-11(13)8-9-19(12-6-7-12)10-14(15,16)17/h11-13,18H,2-10H2,1H3.
What are the key properties of 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine?
2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine has a molecular weight of 278.36 g/mol, XLogP of 3.18, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[cyclopropyl(2,2,2-trifluoroethyl)amino]ethyl]-N-ethylcyclopentan-1-amine is sourced from PubChem (CID 79565712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).