(1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine

C34H29N — CID 142425146

IUPAC(1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine
SMILESCc1cccc2cccc(-c3ccc(C/C=C(\C=C(/N)c4ccccc4)c4ccccc4)cc3)c12
InChIInChI=1S/C34H29N/c1-25-10-8-15-30-16-9-17-32(34(25)30)28-21-18-26(19-22-28)20-23-31(27-11-4-2-5-12-27)24-33(35)29-13-6-3-7-14-29/h2-19,21-24H,20,35H2,1H3/b31-23+,33-24-
InChIKeyZUGUYGIHZUOTGQ-FRLFPXTKSA-N
MW451.61 g/mol
LogP8.44
Rot. Bonds6

About (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine

(1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine (PubChem CID 142425146) has the molecular formula C34H29N and a molecular weight of 451.61 g/mol. Its IUPAC name is (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine.

Molecular Properties

Compound Name(1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine
PubChem CID142425146
Molecular FormulaC34H29N
Molecular Weight451.61 g/mol
Exact Mass451.23
IUPAC Name(1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine
SMILESCc1cccc2cccc(-c3ccc(C/C=C(\C=C(/N)c4ccccc4)c4ccccc4)cc3)c12
InChIInChI=1S/C34H29N/c1-25-10-8-15-30-16-9-17-32(34(25)30)28-21-18-26(19-22-28)20-23-31(27-11-4-2-5-12-27)24-33(35)29-13-6-3-7-14-29/h2-19,21-24H,20,35H2,1H3/b31-23+,33-24-
InChIKeyZUGUYGIHZUOTGQ-FRLFPXTKSA-N
XLogP8.44
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.61
LogP ≤ 58.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine 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

benzenecarboximidamide;(Z)-1-[4-(8-methylnaphthalen-1-yl)phenyl]-3-phenylprop-1-en-1-amine;phenylmethanamine
CID 142425010
(1Z,3E)-3-[2-[4-(aminomethyl)phenyl]naphthalen-1-yl]-1,5-diphenylpenta-1,3-dien-1-amine
CID 142425192
(1Z,3E)-3-[4-[5-[4-(1-amino-1-phenylethyl)phenyl]naphthalen-1-yl]phenyl]-1,5-diphenylpenta-1,3-dien-1-amine;methanimine;toluene
CID 142425214
(1Z,3E)-3-[4-[1-(1,2-diphenylethyl)naphthalen-2-yl]phenyl]-1,5-diphenylpenta-1,3-dien-1-amine
CID 146647346
(1Z,3E)-1,5-diphenyl-3-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]penta-1,3-dien-1-amine
CID 142296330
1-(4-fluorophenyl)-8-methylnaphthalene
CID 57338261
(1Z,3E)-1,5-diphenyl-3-[2-(2-triphenylen-2-ylphenyl)phenyl]penta-1,3-dien-1-amine
CID 142297675
(2E,4Z,6E,8Z)-9-methyl-1-(4-methylphenyl)-3-phenylundeca-2,4,6,8,10-pentaen-5-amine
CID 143239983
(Z)-1-[4-[1-[2-[4-[(2-benzylhydrazinyl)methyl]phenyl]naphthalen-1-yl]naphthalen-2-yl]phenyl]-3-phenylprop-1-en-1-amine
CID 145327197
(1Z,3E)-3-[9,9-dimethyl-6'-[4-(3-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-4'-yl]-1,5-diphenylpenta-1,3-dien-1-amine
CID 142480492
4-[4-(aminomethyl)phenyl]-2-phenylbut-2-enal
CID 174557828
(1Z,3E)-1,5-diphenyl-3-[4-(18-thia-9-azaheptacyclo[18.8.0.02,10.03,8.011,19.012,17.021,26]octacosa-1(20),2(10),3,5,7,11(19),12,14,16,21,23,25,27-tridecaen-9-yl)phenyl]penta-1,3-dien-1-amine
CID 142289977

Frequently Asked Questions

What is the IUPAC name of (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine?
The IUPAC name of (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine (CID 142425146) is (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine.
What is the SMILES notation for (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine?
The canonical SMILES for (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine is Cc1cccc2cccc(-c3ccc(C/C=C(\C=C(/N)c4ccccc4)c4ccccc4)cc3)c12.
What is the InChIKey of (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine?
The InChIKey is ZUGUYGIHZUOTGQ-FRLFPXTKSA-N. The full InChI is InChI=1S/C34H29N/c1-25-10-8-15-30-16-9-17-32(34(25)30)28-21-18-26(19-22-28)20-23-31(27-11-4-2-5-12-27)24-33(35)29-13-6-3-7-14-29/h2-19,21-24H,20,35H2,1H3/b31-23+,33-24-.
What are the key properties of (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine?
(1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine has a molecular weight of 451.61 g/mol, XLogP of 8.44, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E)-5-[4-(8-methylnaphthalen-1-yl)phenyl]-1,3-diphenylpenta-1,3-dien-1-amine is sourced from PubChem (CID 142425146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).