(2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine

C18H19N — CID 145299472

IUPAC(2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine
SMILESC/C=C\C=C(/N)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H19N/c1-2-3-9-18(19)14-15-10-12-17(13-11-15)16-7-5-4-6-8-16/h2-13H,14,19H2,1H3/b3-2-,18-9-
InChIKeyBYVDIQLIYGBOOZ-UFTYEVRSSA-N
MW249.36 g/mol
LogP4.31
Rot. Bonds4

About (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine

(2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine (PubChem CID 145299472) has the molecular formula C18H19N and a molecular weight of 249.36 g/mol. Its IUPAC name is (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine.

Molecular Properties

Compound Name(2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine
PubChem CID145299472
Molecular FormulaC18H19N
Molecular Weight249.36 g/mol
Exact Mass249.15
IUPAC Name(2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine
SMILESC/C=C\C=C(/N)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H19N/c1-2-3-9-18(19)14-15-10-12-17(13-11-15)16-7-5-4-6-8-16/h2-13H,14,19H2,1H3/b3-2-,18-9-
InChIKeyBYVDIQLIYGBOOZ-UFTYEVRSSA-N
XLogP4.31
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine?
The IUPAC name of (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine (CID 145299472) is (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine.
What is the SMILES notation for (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine?
The canonical SMILES for (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine is C/C=C\C=C(/N)Cc1ccc(-c2ccccc2)cc1.
What is the InChIKey of (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine?
The InChIKey is BYVDIQLIYGBOOZ-UFTYEVRSSA-N. The full InChI is InChI=1S/C18H19N/c1-2-3-9-18(19)14-15-10-12-17(13-11-15)16-7-5-4-6-8-16/h2-13H,14,19H2,1H3/b3-2-,18-9-.
What are the key properties of (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine?
(2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine has a molecular weight of 249.36 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z)-1-(4-phenylphenyl)hexa-2,4-dien-2-amine is sourced from PubChem (CID 145299472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).