(Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol

C11H12F3NO — CID 101380706

IUPAC(Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol
SMILESC/C(=C/C(O)C(F)(F)F)Nc1ccccc1
InChIInChI=1S/C11H12F3NO/c1-8(7-10(16)11(12,13)14)15-9-5-3-2-4-6-9/h2-7,10,15-16H,1H3/b8-7-
InChIKeyFEZNDVNEALJFPO-FPLPWBNLSA-N
MW231.22 g/mol
LogP2.93
Rot. Bonds3

About (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol

(Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol (PubChem CID 101380706) has the molecular formula C11H12F3NO and a molecular weight of 231.22 g/mol. Its IUPAC name is (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol.

Molecular Properties

Compound Name(Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol
PubChem CID101380706
Molecular FormulaC11H12F3NO
Molecular Weight231.22 g/mol
Exact Mass231.09
IUPAC Name(Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol
SMILESC/C(=C/C(O)C(F)(F)F)Nc1ccccc1
InChIInChI=1S/C11H12F3NO/c1-8(7-10(16)11(12,13)14)15-9-5-3-2-4-6-9/h2-7,10,15-16H,1H3/b8-7-
InChIKeyFEZNDVNEALJFPO-FPLPWBNLSA-N
XLogP2.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.22
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,1,1-trifluoro-4-phenylpent-3-en-2-ol
CID 54050164
(E)-3-anilinobut-2-enoic acid
CID 89350388
1-phenyl-3-(2,2,2-trifluoro-1-hydroxyethyl)urea
CID 15438831
N-[(Z)-4-methyliminopent-2-en-2-yl]aniline
CID 23579015
(E,2S,6R)-1,1,1,7,7,7-hexafluoro-4-phenylsulfanylhept-3-ene-2,6-diol
CID 101016080
[(E)-2-(4-methoxyanilino)prop-1-enyl]-triphenylphosphanium
CID 101092740
N-[(Z)-4-(butyldiazenyl)pent-2-en-2-yl]aniline
CID 163554773
1,1,1-trifluoropropan-2-yl N-phenylcarbamate
CID 134123596
N-phenylacetamide;trifluoromethanesulfonamide
CID 174361044
4,4,4-trifluorobut-1-ene-1,1,3-triol
CID 154636532
1-anilinoethylidenechromium
CID 519989
cobalt;N-phenylacetamide
CID 158689050

Frequently Asked Questions

What is the IUPAC name of (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol?
The IUPAC name of (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol (CID 101380706) is (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol.
What is the SMILES notation for (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol?
The canonical SMILES for (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol is C/C(=C/C(O)C(F)(F)F)Nc1ccccc1.
What is the InChIKey of (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol?
The InChIKey is FEZNDVNEALJFPO-FPLPWBNLSA-N. The full InChI is InChI=1S/C11H12F3NO/c1-8(7-10(16)11(12,13)14)15-9-5-3-2-4-6-9/h2-7,10,15-16H,1H3/b8-7-.
What are the key properties of (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol?
(Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol has a molecular weight of 231.22 g/mol, XLogP of 2.93, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-anilino-1,1,1-trifluoropent-3-en-2-ol is sourced from PubChem (CID 101380706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).