naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene

C19H16N2 — CID 58979901

IUPACnaphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene
SMILESC/C=C/c1ccc(/N=N/c2ccc3ccccc3c2)cc1
InChIInChI=1S/C19H16N2/c1-2-5-15-8-11-18(12-9-15)20-21-19-13-10-16-6-3-4-7-17(16)14-19/h2-14H,1H3/b5-2+,21-20+
InChIKeyNQMUIMDZQWZEGT-FLPDFBMOSA-N
MW272.35 g/mol
LogP6.29
Rot. Bonds3

About naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene

naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene (PubChem CID 58979901) has the molecular formula C19H16N2 and a molecular weight of 272.35 g/mol. Its IUPAC name is naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene.

Molecular Properties

Compound Namenaphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene
PubChem CID58979901
Molecular FormulaC19H16N2
Molecular Weight272.35 g/mol
Exact Mass272.13
IUPAC Namenaphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene
SMILESC/C=C/c1ccc(/N=N/c2ccc3ccccc3c2)cc1
InChIInChI=1S/C19H16N2/c1-2-5-15-8-11-18(12-9-15)20-21-19-13-10-16-6-3-4-7-17(16)14-19/h2-14H,1H3/b5-2+,21-20+
InChIKeyNQMUIMDZQWZEGT-FLPDFBMOSA-N
XLogP6.29
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.35
LogP ≤ 56.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

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2-[(Z)-2-[3-[3,5-bis[(Z)-prop-1-enyl]phenyl]-5-[(Z)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 134888133
2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 20801533
2-[(1E,3E)-penta-1,3-dienyl]naphthalene
CID 135079977
(3-methoxyphenyl)-naphthalen-2-yldiazene
CID 581663
1-naphthalen-2-yl-N-prop-1-enylmethanimine
CID 71411928
ethane;[(Z)-prop-1-enyl]benzene
CID 90831801
CID 157355117
CID 157355117
1-methoxy-4-prop-1-enylbenzene
CID 67322568
2-[2-[4-(2-tetracen-2-ylethenyl)phenyl]ethenyl]tetracene
CID 76589902
2-[(E)-2-(4-tert-butylphenyl)ethenyl]naphthalene
CID 14597022

Frequently Asked Questions

What is the IUPAC name of naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene?
The IUPAC name of naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene (CID 58979901) is naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene.
What is the SMILES notation for naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene?
The canonical SMILES for naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene is C/C=C/c1ccc(/N=N/c2ccc3ccccc3c2)cc1.
What is the InChIKey of naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene?
The InChIKey is NQMUIMDZQWZEGT-FLPDFBMOSA-N. The full InChI is InChI=1S/C19H16N2/c1-2-5-15-8-11-18(12-9-15)20-21-19-13-10-16-6-3-4-7-17(16)14-19/h2-14H,1H3/b5-2+,21-20+.
What are the key properties of naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene?
naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene has a molecular weight of 272.35 g/mol, XLogP of 6.29, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-2-yl-[4-[(E)-prop-1-enyl]phenyl]diazene is sourced from PubChem (CID 58979901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).