(Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine

C21H23F3N2 — CID 143417048

IUPAC(Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine
SMILESCCN1/C(=C\N)CCCC1c1ccccc1-c1ccccc1C(F)(F)F
InChIInChI=1S/C21H23F3N2/c1-2-26-15(14-25)8-7-13-20(26)18-11-4-3-9-16(18)17-10-5-6-12-19(17)21(22,23)24/h3-6,9-12,14,20H,2,7-8,13,25H2,1H3/b15-14-
InChIKeyYOQFSFJAXSUUJO-PFONDFGASA-N
MW360.42 g/mol
LogP5.72
Rot. Bonds3

About (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine

(Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine (PubChem CID 143417048) has the molecular formula C21H23F3N2 and a molecular weight of 360.42 g/mol. Its IUPAC name is (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine.

Molecular Properties

Compound Name(Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine
PubChem CID143417048
Molecular FormulaC21H23F3N2
Molecular Weight360.42 g/mol
Exact Mass360.18
IUPAC Name(Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine
SMILESCCN1/C(=C\N)CCCC1c1ccccc1-c1ccccc1C(F)(F)F
InChIInChI=1S/C21H23F3N2/c1-2-26-15(14-25)8-7-13-20(26)18-11-4-3-9-16(18)17-10-5-6-12-19(17)21(22,23)24/h3-6,9-12,14,20H,2,7-8,13,25H2,1H3/b15-14-
InChIKeyYOQFSFJAXSUUJO-PFONDFGASA-N
XLogP5.72
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.42
LogP ≤ 55.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine 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

(2S)-2-[2-[2-(trifluoromethyl)phenyl]phenyl]pyrrolidine
CID 126961273
1,4-diethyl-2-[2-(trifluoromethyl)phenyl]-2,4,5,6,7,8-hexahydroquinolin-3-one
CID 139938816
1-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]benzene
CID 3013906
3-[2-(trifluoromethyl)phenyl]cyclohex-2-en-1-amine
CID 65171992
1-(3-chlorocyclohexen-1-yl)-2-(trifluoromethyl)benzene
CID 65177010
2-[2-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroquinazolin-5-amine
CID 62007715
3-(1-ethylpiperidin-2-yl)-1-[2-(trifluoromethyl)phenyl]-5,6-dihydro-4H-pyrrolo[2,3-c]pyrazole
CID 4041891
3-cyclopropyl-4-methyl-5-[[(2S)-2-[2-(trifluoromethyl)phenyl]pyrrolidin-1-yl]methyl]-1,2,4-triazole
CID 97009635
3-ethyl-7-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
CID 136841203
9H-fluoren-9-ylmethyl 3-[2-methyl-3-(trifluoromethyl)phenyl]-9-azabicyclo[3.3.1]non-2-ene-9-carboxylate
CID 171965452
tert-butyl (2S)-2-(2-pyridin-4-ylphenyl)pyrrolidine-1-carboxylate
CID 164551558
(1R)-5-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 156594473

Frequently Asked Questions

What is the IUPAC name of (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine?
The IUPAC name of (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine (CID 143417048) is (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine.
What is the SMILES notation for (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine?
The canonical SMILES for (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine is CCN1/C(=C\N)CCCC1c1ccccc1-c1ccccc1C(F)(F)F.
What is the InChIKey of (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine?
The InChIKey is YOQFSFJAXSUUJO-PFONDFGASA-N. The full InChI is InChI=1S/C21H23F3N2/c1-2-26-15(14-25)8-7-13-20(26)18-11-4-3-9-16(18)17-10-5-6-12-19(17)21(22,23)24/h3-6,9-12,14,20H,2,7-8,13,25H2,1H3/b15-14-.
What are the key properties of (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine?
(Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine has a molecular weight of 360.42 g/mol, XLogP of 5.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-[1-ethyl-6-[2-[2-(trifluoromethyl)phenyl]phenyl]piperidin-2-ylidene]methanamine is sourced from PubChem (CID 143417048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).