N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline

C16H19F3N2 — CID 143206265

IUPACN-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline
SMILESCNCc1ccccc1.CNc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C8H8F3N.C8H11N/c1-12-7-4-2-6(3-5-7)8(9,10)11;1-9-7-8-5-3-2-4-6-8/h2-5,12H,1H3;2-6,9H,7H2,1H3
InChIKeyFHGVPGKHLIWDKS-UHFFFAOYSA-N
MW296.34 g/mol
LogP4.15
Rot. Bonds3

About N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline

N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline (PubChem CID 143206265) has the molecular formula C16H19F3N2 and a molecular weight of 296.34 g/mol. Its IUPAC name is N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline.

Molecular Properties

Compound NameN-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline
PubChem CID143206265
Molecular FormulaC16H19F3N2
Molecular Weight296.34 g/mol
Exact Mass296.15
IUPAC NameN-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline
SMILESCNCc1ccccc1.CNc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C8H8F3N.C8H11N/c1-12-7-4-2-6(3-5-7)8(9,10)11;1-9-7-8-5-3-2-4-6-8/h2-5,12H,1H3;2-6,9H,7H2,1H3
InChIKeyFHGVPGKHLIWDKS-UHFFFAOYSA-N
XLogP4.15
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.34
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-methyl-4-N-[[4-(trifluoromethyl)phenyl]methyl]benzene-1,4-diamine
CID 155032671
borane;N-methyl-1-phenylmethanamine
CID 134979061
N-methyl-1-phenylmethanamine;hydrate;hydrochloride
CID 174315758
N-methyl-1-[3-(trifluoromethyl)phenyl]methanamine;molecular hydrogen
CID 145483676
3-N-methyl-5-N-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3,5-diamine
CID 104534362
N-benzyl-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 24754485
N-methyl-1-[4-(2-phenylethyl)phenyl]methanamine
CID 21395132
1,2-dibenzyl-3-[4-(trifluoromethyl)phenyl]guanidine
CID 135029912
3-(benzylamino)-N-[4-(trifluoromethyl)phenyl]propanamide
CID 42695490
[(R)-(benzylamino)-[4-(trifluoromethyl)phenyl]methyl]azanium
CID 143526238
2,5-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]pyrrol-1-amine
CID 79090628
1-[4-(trifluoromethyl)phenyl]-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine
CID 594666

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline?
The IUPAC name of N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline (CID 143206265) is N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline.
What is the SMILES notation for N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline?
The canonical SMILES for N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline is CNCc1ccccc1.CNc1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline?
The InChIKey is FHGVPGKHLIWDKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3N.C8H11N/c1-12-7-4-2-6(3-5-7)8(9,10)11;1-9-7-8-5-3-2-4-6-8/h2-5,12H,1H3;2-6,9H,7H2,1H3.
What are the key properties of N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline?
N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline has a molecular weight of 296.34 g/mol, XLogP of 4.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-phenylmethanamine;N-methyl-4-(trifluoromethyl)aniline is sourced from PubChem (CID 143206265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).