1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine

C10H19F3N2 — CID 43665301

IUPAC1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCC1CN(C)C(C)CC1NCC(F)(F)F
InChIInChI=1S/C10H19F3N2/c1-7-5-15(3)8(2)4-9(7)14-6-10(11,12)13/h7-9,14H,4-6H2,1-3H3
InChIKeyBPWXKSNDHSCSLC-UHFFFAOYSA-N
MW224.27 g/mol
LogP1.87
Rot. Bonds2

About 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine

1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine (PubChem CID 43665301) has the molecular formula C10H19F3N2 and a molecular weight of 224.27 g/mol. Its IUPAC name is 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine.

Molecular Properties

Compound Name1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine
PubChem CID43665301
Molecular FormulaC10H19F3N2
Molecular Weight224.27 g/mol
Exact Mass224.15
IUPAC Name1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCC1CN(C)C(C)CC1NCC(F)(F)F
InChIInChI=1S/C10H19F3N2/c1-7-5-15(3)8(2)4-9(7)14-6-10(11,12)13/h7-9,14H,4-6H2,1-3H3
InChIKeyBPWXKSNDHSCSLC-UHFFFAOYSA-N
XLogP1.87
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-Isopropyl-3-piperidinyl)methanamine
CID 3157476
rac-(2R,4S)-4-methyl-2-(trifluoromethyl)piperidine
CID 52810925
1-ethyl-N,3-dimethylpiperidin-4-amine
CID 54595021
(4,4-Difluoro-1-methylpiperidin-3-yl)methanamine
CID 83854893
N-methyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43607421
N-(2,2-difluoroethyl)-1-methylpiperidin-4-amine
CID 50896642
N-(2,2-difluoroethyl)-N-methylpiperidin-4-amine dihydrochloride
CID 54595919
N-methyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine hydrochloride
CID 71758336
3-(4-(Trifluoromethyl)piperidin-1-yl)cyclobutan-1-amine
CID 80561869
4-(3,3-Difluorobutyl)piperidine
CID 84656072
rac-(3R,4S)-N,N,3-trimethylpiperidin-4-amine
CID 95352639
[1-(2,2,2-Trifluoroethyl)piperidin-3-yl]methanamine dihydrochloride
CID 119056959

Frequently Asked Questions

What is the IUPAC name of 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine?
The IUPAC name of 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine (CID 43665301) is 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine.
What is the SMILES notation for 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine?
The canonical SMILES for 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine is CC1CN(C)C(C)CC1NCC(F)(F)F.
What is the InChIKey of 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine?
The InChIKey is BPWXKSNDHSCSLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2/c1-7-5-15(3)8(2)4-9(7)14-6-10(11,12)13/h7-9,14H,4-6H2,1-3H3.
What are the key properties of 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine?
1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine has a molecular weight of 224.27 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5-trimethyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine is sourced from PubChem (CID 43665301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).