N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine

C15H15F3N2O — CID 90017318

IUPACN-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine
SMILESCOc1ccc(CNc2nc(C)ccc2C(F)(F)F)cc1
InChIInChI=1S/C15H15F3N2O/c1-10-3-8-13(15(16,17)18)14(20-10)19-9-11-4-6-12(21-2)7-5-11/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyNRLVEOFMUKHELG-UHFFFAOYSA-N
MW296.29 g/mol
LogP4.03
Rot. Bonds4

About N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine

N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine (PubChem CID 90017318) has the molecular formula C15H15F3N2O and a molecular weight of 296.29 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine
PubChem CID90017318
Molecular FormulaC15H15F3N2O
Molecular Weight296.29 g/mol
Exact Mass296.11
IUPAC NameN-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine
SMILESCOc1ccc(CNc2nc(C)ccc2C(F)(F)F)cc1
InChIInChI=1S/C15H15F3N2O/c1-10-3-8-13(15(16,17)18)14(20-10)19-9-11-4-6-12(21-2)7-5-11/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyNRLVEOFMUKHELG-UHFFFAOYSA-N
XLogP4.03
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.29
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-methoxy-N-[(4-methylphenyl)methyl]-2-(trifluoromethyl)quinazolin-4-amine
CID 110431386
N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-6-methoxy-2-methylquinolin-4-amine
CID 166627540
N-[(4-methoxyphenyl)methyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 133366043
2-methoxy-6-methyl-3-(trifluoromethyl)pyridine
CID 70661653
5-[(4-methoxyphenyl)methylamino]-3-(trifluoromethyl)pyridine-2-carbonitrile
CID 25020034
3-fluoro-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
CID 62735098
N-[(4-methoxyphenyl)methyl]-4-(trifluoromethyl)-6-[2-(trifluoromethyl)phenyl]pyridin-2-amine
CID 86657408
2-N-[(3-methoxyphenyl)methyl]-6-methylpyridine-2,3-diamine
CID 81131728
4-N-[(4-methoxyphenyl)methyl]-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106770439
6-chloro-N-[(4-methoxyphenyl)methyl]-2-(trifluoromethyl)pyrimidin-4-amine
CID 106767088
4-N-[(4-methoxyphenyl)methyl]-6-(trifluoromethyl)pyridine-2,4-diamine
CID 177043715
N-[(4-methoxyphenyl)methyl]-4-methyl-1,3-thiazol-2-amine
CID 10728405

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine (CID 90017318) is N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine is COc1ccc(CNc2nc(C)ccc2C(F)(F)F)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine?
The InChIKey is NRLVEOFMUKHELG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N2O/c1-10-3-8-13(15(16,17)18)14(20-10)19-9-11-4-6-12(21-2)7-5-11/h3-8H,9H2,1-2H3,(H,19,20).
What are the key properties of N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine?
N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine has a molecular weight of 296.29 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-6-methyl-3-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 90017318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).