N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine

C9H17F3N2 — CID 63226778

IUPACN-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine
SMILESCNC1CCN(CCC(F)(F)F)CC1
InChIInChI=1S/C9H17F3N2/c1-13-8-2-5-14(6-3-8)7-4-9(10,11)12/h8,13H,2-7H2,1H3
InChIKeyNIPQVFDTZJOSDG-UHFFFAOYSA-N
MW210.24 g/mol
LogP1.62
Rot. Bonds3

About N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine

N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine (PubChem CID 63226778) has the molecular formula C9H17F3N2 and a molecular weight of 210.24 g/mol. Its IUPAC name is N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine
PubChem CID63226778
Molecular FormulaC9H17F3N2
Molecular Weight210.24 g/mol
Exact Mass210.13
IUPAC NameN-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine
SMILESCNC1CCN(CCC(F)(F)F)CC1
InChIInChI=1S/C9H17F3N2/c1-13-8-2-5-14(6-3-8)7-4-9(10,11)12/h8,13H,2-7H2,1H3
InChIKeyNIPQVFDTZJOSDG-UHFFFAOYSA-N
XLogP1.62
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 51.62
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-(2,2,2-Trifluoroethyl)piperidin-4-amine
CID 16228722
1-Propylpiperidin-4-amine
CID 541730
N-pentylpiperidin-4-amine
CID 44592820
1-(3-Aminopropyl)-2-pipecoline
CID 520211
1-(3-Aminopropyl)-2-pipecoline
CID 520211

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine?
The IUPAC name of N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine (CID 63226778) is N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine.
What is the SMILES notation for N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine?
The canonical SMILES for N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine is CNC1CCN(CCC(F)(F)F)CC1.
What is the InChIKey of N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine?
The InChIKey is NIPQVFDTZJOSDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F3N2/c1-13-8-2-5-14(6-3-8)7-4-9(10,11)12/h8,13H,2-7H2,1H3.
What are the key properties of N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine?
N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine has a molecular weight of 210.24 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine is sourced from PubChem (CID 63226778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).