naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene

C30H20N2 — CID 87715057

IUPACnaphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene
SMILESc1ccc2c(/N=N/c3c(-c4cccc5ccccc45)ccc4ccccc34)cccc2c1
InChIInChI=1S/C30H20N2/c1-4-14-24-21(9-1)12-7-17-27(24)28-20-19-23-11-3-6-16-26(23)30(28)32-31-29-18-8-13-22-10-2-5-15-25(22)29/h1-20H/b32-31+
InChIKeyISWHSRJNZVTPQM-QNEJGDQOSA-N
MW408.50 g/mol
LogP9.23
Rot. Bonds3

About naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene

naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene (PubChem CID 87715057) has the molecular formula C30H20N2 and a molecular weight of 408.50 g/mol. Its IUPAC name is naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene.

Molecular Properties

Compound Namenaphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene
PubChem CID87715057
Molecular FormulaC30H20N2
Molecular Weight408.50 g/mol
Exact Mass408.16
IUPAC Namenaphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene
SMILESc1ccc2c(/N=N/c3c(-c4cccc5ccccc45)ccc4ccccc34)cccc2c1
InChIInChI=1S/C30H20N2/c1-4-14-24-21(9-1)12-7-17-27(24)28-20-19-23-11-3-6-16-26(23)30(28)32-31-29-18-8-13-22-10-2-5-15-25(22)29/h1-20H/b32-31+
InChIKeyISWHSRJNZVTPQM-QNEJGDQOSA-N
XLogP9.23
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.50
LogP ≤ 59.23
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

CID 175078571
CID 175078571
1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
CID 59169251
CID 175282704
CID 175282704
bis(1-naphthalen-1-ylnaphthalene);phosphane
CID 175426418
tetrakis(1-naphthalen-1-ylnaphthalene);tetrahydrochloride
CID 173126408
1-naphthalen-1-ylnaphthalene;tetrahydrochloride
CID 68981096
1-naphthalen-1-ylnaphthalene;ruthenium(2+);dichloride
CID 11327769
9-naphthalen-1-yl-10-[4-[4-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]naphthalen-1-yl]anthracene
CID 59861499
(2-bromophenyl)-naphthalen-1-yldiazene
CID 581691
4,20-dinaphthalen-1-yl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene
CID 58461828
9-naphthalen-1-yl-10-(4-phenanthren-4-ylnaphthalen-1-yl)anthracene
CID 58194513
phenyl-(1-phenyldiazenylnaphthalen-2-yl)diazene
CID 22616925

Frequently Asked Questions

What is the IUPAC name of naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene?
The IUPAC name of naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene (CID 87715057) is naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene.
What is the SMILES notation for naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene?
The canonical SMILES for naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene is c1ccc2c(/N=N/c3c(-c4cccc5ccccc45)ccc4ccccc34)cccc2c1.
What is the InChIKey of naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene?
The InChIKey is ISWHSRJNZVTPQM-QNEJGDQOSA-N. The full InChI is InChI=1S/C30H20N2/c1-4-14-24-21(9-1)12-7-17-27(24)28-20-19-23-11-3-6-16-26(23)30(28)32-31-29-18-8-13-22-10-2-5-15-25(22)29/h1-20H/b32-31+.
What are the key properties of naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene?
naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene has a molecular weight of 408.50 g/mol, XLogP of 9.23, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-1-yl-(2-naphthalen-1-ylnaphthalen-1-yl)diazene is sourced from PubChem (CID 87715057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).