N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine

C16H17F3N2 — CID 63541640

IUPACN-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine
SMILESCC(C)(CNc1ncccc1C(F)(F)F)c1ccccc1
InChIInChI=1S/C16H17F3N2/c1-15(2,12-7-4-3-5-8-12)11-21-14-13(16(17,18)19)9-6-10-20-14/h3-10H,11H2,1-2H3,(H,20,21)
InChIKeyIHIRDDTYGLYCRR-UHFFFAOYSA-N
MW294.32 g/mol
LogP4.49
Rot. Bonds4

About N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine

N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine (PubChem CID 63541640) has the molecular formula C16H17F3N2 and a molecular weight of 294.32 g/mol. Its IUPAC name is N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine
PubChem CID63541640
Molecular FormulaC16H17F3N2
Molecular Weight294.32 g/mol
Exact Mass294.13
IUPAC NameN-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine
SMILESCC(C)(CNc1ncccc1C(F)(F)F)c1ccccc1
InChIInChI=1S/C16H17F3N2/c1-15(2,12-7-4-3-5-8-12)11-21-14-13(16(17,18)19)9-6-10-20-14/h3-10H,11H2,1-2H3,(H,20,21)
InChIKeyIHIRDDTYGLYCRR-UHFFFAOYSA-N
XLogP4.49
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.32
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine
CID 54886580
N-ethyl-3-(trifluoromethyl)pyridin-2-amine
CID 23541253
2-N,2-N,2-trimethyl-1-N-[3-(trifluoromethyl)-2-pyridinyl]propane-1,2-diamine
CID 54942856
3-methyl-2-[[[3-(trifluoromethyl)-2-pyridinyl]amino]methyl]butanoic acid
CID 65226846
N-(2-methyl-2-phenylpropyl)pyridin-2-amine
CID 60970281
N'-[3-(trifluoromethyl)-2-pyridinyl]ethane-1,2-diamine
CID 23293787
3-(trifluoromethyl)-N-(3,3,3-trifluoropropyl)pyridin-2-amine
CID 63226841
2-methyl-2-[[3-(trifluoromethyl)-2-pyridinyl]amino]propanoic acid
CID 61266117
2,4-dimethyl-1-[[3-(trifluoromethyl)-2-pyridinyl]amino]pentan-2-ol
CID 66180973
N-[(E)-pent-3-enyl]-3-(trifluoromethyl)pyridin-2-amine
CID 115628581
N-[(2-bromophenyl)methyl]-3-(trifluoromethyl)pyridin-2-amine
CID 61402525
2,2,3-trimethyl-3-[[3-(trifluoromethyl)-2-pyridinyl]amino]butanoic acid
CID 65266327

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine (CID 63541640) is N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine is CC(C)(CNc1ncccc1C(F)(F)F)c1ccccc1.
What is the InChIKey of N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine?
The InChIKey is IHIRDDTYGLYCRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17F3N2/c1-15(2,12-7-4-3-5-8-12)11-21-14-13(16(17,18)19)9-6-10-20-14/h3-10H,11H2,1-2H3,(H,20,21).
What are the key properties of N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine?
N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine has a molecular weight of 294.32 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 63541640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).