N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline

C14H13F3N2 — CID 43192853

IUPACN-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline
SMILESCC(Nc1ccc(C(F)(F)F)cc1)c1ccccn1
InChIInChI=1S/C14H13F3N2/c1-10(13-4-2-3-9-18-13)19-12-7-5-11(6-8-12)14(15,16)17/h2-10,19H,1H3
InChIKeyCZSYZUAHLXVLBG-UHFFFAOYSA-N
MW266.27 g/mol
LogP4.27
Rot. Bonds3

About N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline

N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline (PubChem CID 43192853) has the molecular formula C14H13F3N2 and a molecular weight of 266.27 g/mol. Its IUPAC name is N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline.

Molecular Properties

Compound NameN-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline
PubChem CID43192853
Molecular FormulaC14H13F3N2
Molecular Weight266.27 g/mol
Exact Mass266.10
IUPAC NameN-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline
SMILESCC(Nc1ccc(C(F)(F)F)cc1)c1ccccn1
InChIInChI=1S/C14H13F3N2/c1-10(13-4-2-3-9-18-13)19-12-7-5-11(6-8-12)14(15,16)17/h2-10,19H,1H3
InChIKeyCZSYZUAHLXVLBG-UHFFFAOYSA-N
XLogP4.27
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.27
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-(1-pyridin-2-ylethyl)aniline
CID 43194293
4-(1-pyridin-2-ylethylamino)phenol
CID 43742707
2-propan-2-ylpyridine;1-propan-2-yl-4-(trifluoromethyl)benzene
CID 162046659
6-N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717521
2-nitro-N-[(1S)-1-pyridin-2-ylethyl]-4-(trifluoromethyl)aniline
CID 40714525
4-(aminomethyl)-N-(1-pyridin-2-ylethyl)-6-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine
CID 68761295
3,5-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43195401
ethane;pyridin-2-yl-[4-(trifluoromethyl)phenyl]methanamine
CID 145107737
3-bromo-4-fluoro-N-(1-pyridin-2-ylethyl)aniline
CID 113354964
3-chloro-4-fluoro-N-(1-pyridin-2-ylethyl)aniline
CID 43119234
(S)-pyridin-2-yl-[4-(trifluoromethyl)phenyl]methanamine
CID 71164818
N-[4-(1-pyridin-2-ylethylamino)phenyl]propanamide
CID 43720633

Frequently Asked Questions

What is the IUPAC name of N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline?
The IUPAC name of N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline (CID 43192853) is N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline.
What is the SMILES notation for N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline?
The canonical SMILES for N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline is CC(Nc1ccc(C(F)(F)F)cc1)c1ccccn1.
What is the InChIKey of N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline?
The InChIKey is CZSYZUAHLXVLBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2/c1-10(13-4-2-3-9-18-13)19-12-7-5-11(6-8-12)14(15,16)17/h2-10,19H,1H3.
What are the key properties of N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline?
N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline has a molecular weight of 266.27 g/mol, XLogP of 4.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline is sourced from PubChem (CID 43192853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).