N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine

C11H21F3N2 — CID 115512946

IUPACN-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine
SMILESCCNC1CCN(CCCC(F)(F)F)CC1
InChIInChI=1S/C11H21F3N2/c1-2-15-10-4-8-16(9-5-10)7-3-6-11(12,13)14/h10,15H,2-9H2,1H3
InChIKeyPIFLALFLVLAXQH-UHFFFAOYSA-N
MW238.30 g/mol
LogP2.40
Rot. Bonds5

About N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine

N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine (PubChem CID 115512946) has the molecular formula C11H21F3N2 and a molecular weight of 238.30 g/mol. Its IUPAC name is N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine
PubChem CID115512946
Molecular FormulaC11H21F3N2
Molecular Weight238.30 g/mol
Exact Mass238.17
IUPAC NameN-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine
SMILESCCNC1CCN(CCCC(F)(F)F)CC1
InChIInChI=1S/C11H21F3N2/c1-2-15-10-4-8-16(9-5-10)7-3-6-11(12,13)14/h10,15H,2-9H2,1H3
InChIKeyPIFLALFLVLAXQH-UHFFFAOYSA-N
XLogP2.40
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.30
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-Dimethylpiperidin-4-amine
CID 417391
1-Methyl-4-(methylamino)piperidine
CID 566323
1-(Propan-2-yl)piperidin-4-amine
CID 3163333
1-Ethylpiperidin-4-amine
CID 3734990
N,N-diethylpiperidin-4-amine
CID 2758239
N,N-dipropylpiperidin-4-amine
CID 3824021
N-(Propan-2-yl)piperidin-4-amine
CID 22394351
1-Butylpiperidin-4-amine
CID 12262820
1-(2,2,2-Trifluoroethyl)piperidin-4-amine
CID 16228722
1-(2,2-Difluoroethyl)-4-piperidinamine
CID 25252389
N,1-dimethyl-N-[2-(methylamino)ethyl]piperidin-4-amine
CID 28598734
1-Propylpiperidin-4-amine
CID 541730

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine?
The IUPAC name of N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine (CID 115512946) is N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine?
The canonical SMILES for N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine is CCNC1CCN(CCCC(F)(F)F)CC1.
What is the InChIKey of N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine?
The InChIKey is PIFLALFLVLAXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2/c1-2-15-10-4-8-16(9-5-10)7-3-6-11(12,13)14/h10,15H,2-9H2,1H3.
What are the key properties of N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine?
N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine has a molecular weight of 238.30 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine is sourced from PubChem (CID 115512946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).