4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine

C22H23N3 — CID 159994719

IUPAC4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine
SMILESNc1cc(/C(=C\CCCc2ccccc2)c2ccccc2)cc(N)n1
InChIInChI=1S/C22H23N3/c23-21-15-19(16-22(24)25-21)20(18-12-5-2-6-13-18)14-8-7-11-17-9-3-1-4-10-17/h1-6,9-10,12-16H,7-8,11H2,(H4,23,24,25)/b20-14-
InChIKeyFHKIZMPVEQXUOD-ZHZULCJRSA-N
MW329.45 g/mol
LogP4.70
Rot. Bonds6

About 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine

4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine (PubChem CID 159994719) has the molecular formula C22H23N3 and a molecular weight of 329.45 g/mol. Its IUPAC name is 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine.

Molecular Properties

Compound Name4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine
PubChem CID159994719
Molecular FormulaC22H23N3
Molecular Weight329.45 g/mol
Exact Mass329.19
IUPAC Name4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine
SMILESNc1cc(/C(=C\CCCc2ccccc2)c2ccccc2)cc(N)n1
InChIInChI=1S/C22H23N3/c23-21-15-19(16-22(24)25-21)20(18-12-5-2-6-13-18)14-8-7-11-17-9-3-1-4-10-17/h1-6,9-10,12-16H,7-8,11H2,(H4,23,24,25)/b20-14-
InChIKeyFHKIZMPVEQXUOD-ZHZULCJRSA-N
XLogP4.70
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[(E)-3-amino-1-phenylprop-1-enyl]pyridine-2,6-diamine
CID 130450605
4,4-diphenyl-N-(3-phenylpropyl)but-3-en-1-amine
CID 86174000
[(E)-5-phenylhex-4-enyl]benzene
CID 14767514
5,5-difluoropent-4-enylbenzene
CID 15268524
[(3E,5Z)-1,9-diphenylnona-3,5-dien-5-yl]benzene
CID 16664377
4-(1-phenyl-2-pyridin-2-ylethenyl)pyridine-2,6-diamine
CID 155099404
1-phenylhepta-1,6-dienylbenzene
CID 11021254
2-(6,6-diphenylhex-5-enyl)-1,3-benzoxazole
CID 102258045
1-(4,4-diphenylbut-3-enyl)-4-methoxybenzene
CID 11415775
(4-bromo-1-phenylbut-1-enyl)benzene
CID 10401774
1-[3-[(2,6-diamino-4-pyridinyl)methyl]phenyl]-3-phenylpropan-1-one
CID 157197212
5,5-diphenyl-N-(1-phenylethyl)pent-4-en-1-amine;hydrochloride
CID 67609391

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine?
The IUPAC name of 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine (CID 159994719) is 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine.
What is the SMILES notation for 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine?
The canonical SMILES for 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine is Nc1cc(/C(=C\CCCc2ccccc2)c2ccccc2)cc(N)n1.
What is the InChIKey of 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine?
The InChIKey is FHKIZMPVEQXUOD-ZHZULCJRSA-N. The full InChI is InChI=1S/C22H23N3/c23-21-15-19(16-22(24)25-21)20(18-12-5-2-6-13-18)14-8-7-11-17-9-3-1-4-10-17/h1-6,9-10,12-16H,7-8,11H2,(H4,23,24,25)/b20-14-.
What are the key properties of 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine?
4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine has a molecular weight of 329.45 g/mol, XLogP of 4.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1,5-diphenylpent-1-enyl]pyridine-2,6-diamine is sourced from PubChem (CID 159994719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).