5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine

C14H25F3N2 — CID 79865497

IUPAC5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine
SMILESCNC1C(CN(CC(F)(F)F)C2CC2)CCC1(C)C
InChIInChI=1S/C14H25F3N2/c1-13(2)7-6-10(12(13)18-3)8-19(11-4-5-11)9-14(15,16)17/h10-12,18H,4-9H2,1-3H3
InChIKeyZKWWTLDIUJHDGH-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.04
Rot. Bonds5

About 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine

5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine (PubChem CID 79865497) has the molecular formula C14H25F3N2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine.

Molecular Properties

Compound Name5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine
PubChem CID79865497
Molecular FormulaC14H25F3N2
Molecular Weight278.36 g/mol
Exact Mass278.20
IUPAC Name5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine
SMILESCNC1C(CN(CC(F)(F)F)C2CC2)CCC1(C)C
InChIInChI=1S/C14H25F3N2/c1-13(2)7-6-10(12(13)18-3)8-19(11-4-5-11)9-14(15,16)17/h10-12,18H,4-9H2,1-3H3
InChIKeyZKWWTLDIUJHDGH-UHFFFAOYSA-N
XLogP3.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol
CID 79855562
6-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclohexan-1-amine
CID 79852225
5-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79855711
1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl-methylamino]-2-methylpropan-2-ol
CID 79856035
1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl-ethylamino]-2-methylpropan-2-ol
CID 79855042
5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine
CID 79855110
5-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79867191
N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine
CID 82743146
N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methylthiolan-3-amine
CID 79865895
2-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl-methylamino]propan-1-ol
CID 104554577
2-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N-ethylcycloheptan-1-amine
CID 62609086
2-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 62608869

Frequently Asked Questions

What is the IUPAC name of 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine?
The IUPAC name of 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine (CID 79865497) is 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine.
What is the SMILES notation for 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine?
The canonical SMILES for 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine is CNC1C(CN(CC(F)(F)F)C2CC2)CCC1(C)C.
What is the InChIKey of 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine?
The InChIKey is ZKWWTLDIUJHDGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2/c1-13(2)7-6-10(12(13)18-3)8-19(11-4-5-11)9-14(15,16)17/h10-12,18H,4-9H2,1-3H3.
What are the key properties of 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine?
5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine has a molecular weight of 278.36 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine is sourced from PubChem (CID 79865497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).