N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine

C7H11F3N2 — CID 175795897

IUPACN-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine
SMILESCNN1CCCC=C1C(F)(F)F
InChIInChI=1S/C7H11F3N2/c1-11-12-5-3-2-4-6(12)7(8,9)10/h4,11H,2-3,5H2,1H3
InChIKeyHLVADKHEDDNAKW-UHFFFAOYSA-N
MW180.17 g/mol
LogP1.66
Rot. Bonds1

About N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine

N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine (PubChem CID 175795897) has the molecular formula C7H11F3N2 and a molecular weight of 180.17 g/mol. Its IUPAC name is N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine.

Molecular Properties

Compound NameN-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine
PubChem CID175795897
Molecular FormulaC7H11F3N2
Molecular Weight180.17 g/mol
Exact Mass180.09
IUPAC NameN-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine
SMILESCNN1CCCC=C1C(F)(F)F
InChIInChI=1S/C7H11F3N2/c1-11-12-5-3-2-4-6(12)7(8,9)10/h4,11H,2-3,5H2,1H3
InChIKeyHLVADKHEDDNAKW-UHFFFAOYSA-N
XLogP1.66
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.17
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine?
The IUPAC name of N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine (CID 175795897) is N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine.
What is the SMILES notation for N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine?
The canonical SMILES for N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine is CNN1CCCC=C1C(F)(F)F.
What is the InChIKey of N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine?
The InChIKey is HLVADKHEDDNAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3N2/c1-11-12-5-3-2-4-6(12)7(8,9)10/h4,11H,2-3,5H2,1H3.
What are the key properties of N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine?
N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine has a molecular weight of 180.17 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(trifluoromethyl)-3,4-dihydro-2H-pyridin-1-amine is sourced from PubChem (CID 175795897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).