N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine

C14H13F3N2O — CID 62464814

IUPACN-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine
SMILESCNc1ncccc1COc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H13F3N2O/c1-18-13-10(3-2-8-19-13)9-20-12-6-4-11(5-7-12)14(15,16)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyOQXHZUNTRYFDKL-UHFFFAOYSA-N
MW282.27 g/mol
LogP3.72
Rot. Bonds4

About N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine

N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine (PubChem CID 62464814) has the molecular formula C14H13F3N2O and a molecular weight of 282.27 g/mol. Its IUPAC name is N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine
PubChem CID62464814
Molecular FormulaC14H13F3N2O
Molecular Weight282.27 g/mol
Exact Mass282.10
IUPAC NameN-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine
SMILESCNc1ncccc1COc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H13F3N2O/c1-18-13-10(3-2-8-19-13)9-20-12-6-4-11(5-7-12)14(15,16)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyOQXHZUNTRYFDKL-UHFFFAOYSA-N
XLogP3.72
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(4-iodophenoxy)methyl]-N-methylpyridin-2-amine
CID 62464965
3-(methoxymethyl)-N-methylpyridin-2-amine
CID 62464572
1-ethyl-2-[[4-(trifluoromethyl)phenoxy]methyl]benzene
CID 171509620
3-[[2-(methylamino)-3-pyridinyl]methoxy]benzonitrile
CID 62464085
3-[[4-(trifluoromethyl)phenoxy]methyl]pyridine-2-carboximidamide
CID 62893556
[3-[(4-fluorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 62465552
3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine
CID 62464422
N-methyl-3-[(2,4,6-tribromophenoxy)methyl]pyridin-2-amine
CID 63485474
3-[(2,3-dimethylphenoxy)methyl]-N-methylpyridin-2-amine
CID 62464069
3-ethyl-N-methylpyridin-2-amine;dihydrochloride
CID 70603683
tert-butyl [2-(methylamino)-3-pyridinyl]methyl carbonate
CID 59769540
3-[(4-bromophenoxy)methyl]-N-propylpyridin-2-amine
CID 55075630

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine?
The IUPAC name of N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine (CID 62464814) is N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine is CNc1ncccc1COc1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine?
The InChIKey is OQXHZUNTRYFDKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2O/c1-18-13-10(3-2-8-19-13)9-20-12-6-4-11(5-7-12)14(15,16)17/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine?
N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine has a molecular weight of 282.27 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyridin-2-amine is sourced from PubChem (CID 62464814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).