(1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine

C11H14F3NO — CID 141191403

IUPAC(1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine
SMILESCC[C@@H](NC)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C11H14F3NO/c1-3-10(15-2)8-4-6-9(7-5-8)16-11(12,13)14/h4-7,10,15H,3H2,1-2H3/t10-/m1/s1
InChIKeyVHPQWGOUGGFCRR-SNVBAGLBSA-N
MW233.23 g/mol
LogP3.26
Rot. Bonds4

About (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine

(1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine (PubChem CID 141191403) has the molecular formula C11H14F3NO and a molecular weight of 233.23 g/mol. Its IUPAC name is (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine.

Molecular Properties

Compound Name(1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine
PubChem CID141191403
Molecular FormulaC11H14F3NO
Molecular Weight233.23 g/mol
Exact Mass233.10
IUPAC Name(1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine
SMILESCC[C@@H](NC)c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C11H14F3NO/c1-3-10(15-2)8-4-6-9(7-5-8)16-11(12,13)14/h4-7,10,15H,3H2,1-2H3/t10-/m1/s1
InChIKeyVHPQWGOUGGFCRR-SNVBAGLBSA-N
XLogP3.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-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

N-ethyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine
CID 114980102
N-methyl-2-pyridin-2-yl-1-[4-(trifluoromethoxy)phenyl]ethanamine
CID 116628886
1-[4-(difluoromethoxy)phenyl]-N-methylpropan-1-amine
CID 43280106
1-[4-(trifluoromethoxy)phenyl]butylhydrazine
CID 105282256
[(1R)-1-[4-(trifluoromethoxy)phenyl]propyl]azanide
CID 162105991
1-(1-bromopropyl)-4-(trifluoromethoxy)benzene
CID 53466431
N-[1-[4-(trifluoromethoxy)phenyl]ethyl]butan-2-amine
CID 43190319
N-ethyl-1-[4-(trifluoromethoxy)phenyl]ethanamine
CID 24697408
N-propyl-1-[4-(trifluoromethoxy)phenyl]pentan-1-amine
CID 115832666
N-ethyl-1-[4-(trifluoromethoxy)phenyl]but-3-en-1-amine
CID 115815205
3-methyl-N-propyl-1-[4-(trifluoromethoxy)phenyl]butan-1-amine
CID 115782110
N'-methyl-1,2-bis[4-(trifluoromethoxy)phenyl]ethane-1,2-diamine
CID 166838574

Frequently Asked Questions

What is the IUPAC name of (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine?
The IUPAC name of (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine (CID 141191403) is (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine.
What is the SMILES notation for (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine?
The canonical SMILES for (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine is CC[C@@H](NC)c1ccc(OC(F)(F)F)cc1.
What is the InChIKey of (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine?
The InChIKey is VHPQWGOUGGFCRR-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H14F3NO/c1-3-10(15-2)8-4-6-9(7-5-8)16-11(12,13)14/h4-7,10,15H,3H2,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine?
(1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine has a molecular weight of 233.23 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-methyl-1-[4-(trifluoromethoxy)phenyl]propan-1-amine is sourced from PubChem (CID 141191403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).