N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine

C10H19F3N2 — CID 115514843

IUPACN-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine
SMILESCN(CCCC(F)(F)F)C1CCNCC1
InChIInChI=1S/C10H19F3N2/c1-15(8-2-5-10(11,12)13)9-3-6-14-7-4-9/h9,14H,2-8H2,1H3
InChIKeyCDAAKGINKCIJJP-UHFFFAOYSA-N
MW224.27 g/mol
LogP2.01
Rot. Bonds4

About N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine

N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine (PubChem CID 115514843) has the molecular formula C10H19F3N2 and a molecular weight of 224.27 g/mol. Its IUPAC name is N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine
PubChem CID115514843
Molecular FormulaC10H19F3N2
Molecular Weight224.27 g/mol
Exact Mass224.15
IUPAC NameN-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine
SMILESCN(CCCC(F)(F)F)C1CCNCC1
InChIInChI=1S/C10H19F3N2/c1-15(8-2-5-10(11,12)13)9-3-6-14-7-4-9/h9,14H,2-8H2,1H3
InChIKeyCDAAKGINKCIJJP-UHFFFAOYSA-N
XLogP2.01
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 64567145
N-methyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43607421
methane;(3R)-N-methyl-N-(3,3,3-trifluoropropyl)pyrrolidin-3-amine
CID 157275327
N,N'-dimethyl-N,N'-di(piperidin-4-yl)ethane-1,2-diamine;tetrahydrochloride
CID 18770418
N-butyl-N-methylpiperidin-4-amine;dihydrochloride
CID 53410849
3-[methyl(piperidin-4-yl)amino]propan-1-ol
CID 12019499
N-methyl-N-[2-(trifluoromethylsulfanyl)ethyl]azepan-4-amine
CID 107173387
N'-cyclohexyl-N'-methyl-N-(4,4,4-trifluorobutyl)propane-1,3-diamine
CID 115513573
N,4-dimethyl-N-(3-piperidin-4-ylpropyl)cyclohexan-1-amine
CID 62212511
N'-cyclopentyl-N'-methyl-N-(4,4,4-trifluorobutyl)ethane-1,2-diamine
CID 113326351
N-methyl-N-[2-(oxan-4-yl)ethyl]piperidin-4-amine
CID 115118538
trifluoro-[[methyl(piperidin-4-yl)amino]methyl]boranuide
CID 63705433

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine?
The IUPAC name of N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine (CID 115514843) is N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine.
What is the SMILES notation for N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine?
The canonical SMILES for N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine is CN(CCCC(F)(F)F)C1CCNCC1.
What is the InChIKey of N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine?
The InChIKey is CDAAKGINKCIJJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2/c1-15(8-2-5-10(11,12)13)9-3-6-14-7-4-9/h9,14H,2-8H2,1H3.
What are the key properties of N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine?
N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine has a molecular weight of 224.27 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4,4,4-trifluorobutyl)piperidin-4-amine is sourced from PubChem (CID 115514843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).