N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine

C7H8F3NO — CID 171487745

IUPACN-methyl-6-(trifluoromethyl)-2H-pyran-4-amine
SMILESCNC1=CCOC(C(F)(F)F)=C1
InChIInChI=1S/C7H8F3NO/c1-11-5-2-3-12-6(4-5)7(8,9)10/h2,4,11H,3H2,1H3
InChIKeyWXVDTDVJJVFCFJ-UHFFFAOYSA-N
MW179.14 g/mol
LogP1.57
Rot. Bonds1

About N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine

N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine (PubChem CID 171487745) has the molecular formula C7H8F3NO and a molecular weight of 179.14 g/mol. Its IUPAC name is N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine.

Molecular Properties

Compound NameN-methyl-6-(trifluoromethyl)-2H-pyran-4-amine
PubChem CID171487745
Molecular FormulaC7H8F3NO
Molecular Weight179.14 g/mol
Exact Mass179.06
IUPAC NameN-methyl-6-(trifluoromethyl)-2H-pyran-4-amine
SMILESCNC1=CCOC(C(F)(F)F)=C1
InChIInChI=1S/C7H8F3NO/c1-11-5-2-3-12-6(4-5)7(8,9)10/h2,4,11H,3H2,1H3
InChIKeyWXVDTDVJJVFCFJ-UHFFFAOYSA-N
XLogP1.57
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.14
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3Z,5E)-N-methyl-5-(trifluoromethoxy)hepta-1,3,5-trien-2-amine
CID 143206141
(3Z)-N-methyl-5-(trifluoromethoxy)hexa-1,3,5-trien-2-amine
CID 143206173
(3E,5E)-4-fluoro-5-methoxy-N-methylhepta-1,3,5-trien-2-amine
CID 143206210
(3E)-4-fluoro-5-methoxy-N-methylhexa-1,3,5-trien-2-amine
CID 143206346
(3E)-5-fluoro-4-methoxy-N-methylhexa-1,3,5-trien-2-amine
CID 143206396
(3Z)-4-(difluoromethoxy)-N-methylhexa-1,3,5-trien-3-amine
CID 143782131
(2E,4Z)-N-methyl-6-(trifluoromethoxy)hexa-2,4-dien-3-amine
CID 155197758
2-methylidene-4-(2,2,3,3,3-pentafluoropropoxy)-1H-pyridine
CID 165394094
(3Z,5E)-6-fluoro-N-methyl-4-propan-2-yloxyhepta-1,3,5-trien-3-amine
CID 166943959
N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine;hydrochloride
CID 171487744
N-methyl-2H-pyran-4-amine;hydrochloride
CID 69002804
N-methyl-2H-pyran-4-amine
CID 69002805

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine?
The IUPAC name of N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine (CID 171487745) is N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine.
What is the SMILES notation for N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine?
The canonical SMILES for N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine is CNC1=CCOC(C(F)(F)F)=C1.
What is the InChIKey of N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine?
The InChIKey is WXVDTDVJJVFCFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3NO/c1-11-5-2-3-12-6(4-5)7(8,9)10/h2,4,11H,3H2,1H3.
What are the key properties of N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine?
N-methyl-6-(trifluoromethyl)-2H-pyran-4-amine has a molecular weight of 179.14 g/mol, XLogP of 1.57, 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)-2H-pyran-4-amine is sourced from PubChem (CID 171487745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).