1,1,2,2-tetranaphthalen-1-ylhydrazine

C40H28N2 — CID 21439529

IUPAC1,1,2,2-tetranaphthalen-1-ylhydrazine
SMILESc1ccc2c(N(c3cccc4ccccc34)N(c3cccc4ccccc34)c3cccc4ccccc34)cccc2c1
InChIInChI=1S/C40H28N2/c1-5-21-33-29(13-1)17-9-25-37(33)41(38-26-10-18-30-14-2-6-22-34(30)38)42(39-27-11-19-31-15-3-7-23-35(31)39)40-28-12-20-32-16-4-8-24-36(32)40/h1-28H
InChIKeyHDDDHBFDRRRUGT-UHFFFAOYSA-N
MW536.68 g/mol
LogP11.19
Rot. Bonds5

About 1,1,2,2-tetranaphthalen-1-ylhydrazine

1,1,2,2-tetranaphthalen-1-ylhydrazine (PubChem CID 21439529) has the molecular formula C40H28N2 and a molecular weight of 536.68 g/mol. Its IUPAC name is 1,1,2,2-tetranaphthalen-1-ylhydrazine.

Molecular Properties

Compound Name1,1,2,2-tetranaphthalen-1-ylhydrazine
PubChem CID21439529
Molecular FormulaC40H28N2
Molecular Weight536.68 g/mol
Exact Mass536.23
IUPAC Name1,1,2,2-tetranaphthalen-1-ylhydrazine
SMILESc1ccc2c(N(c3cccc4ccccc34)N(c3cccc4ccccc34)c3cccc4ccccc34)cccc2c1
InChIInChI=1S/C40H28N2/c1-5-21-33-29(13-1)17-9-25-37(33)41(38-26-10-18-30-14-2-6-22-34(30)38)42(39-27-11-19-31-15-3-7-23-35(31)39)40-28-12-20-32-16-4-8-24-36(32)40/h1-28H
InChIKeyHDDDHBFDRRRUGT-UHFFFAOYSA-N
XLogP11.19
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.68
LogP ≤ 511.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N-diphenylnaphthalen-1-amine
CID 11392281
N,N-dimethylnaphthalen-1-amine;sulfuric acid
CID 159908177
4-(N-(dinaphthalen-1-ylamino)-4-hydroxy-3-methylanilino)-2-methylphenol
CID 21439528
N,N-dimethylnaphthalen-1-amine;hydroxylamine
CID 135773162
1-N,4-N-dinaphthalen-1-yl-4-N-[4-[N-naphthalen-1-yl-4-(N-naphthalen-1-ylanilino)anilino]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 87744556
N-naphthalen-1-yl-N-phenylthiohydroxylamine
CID 57319297
1-N-[4-[4-(N-naphthalen-1-ylanilino)-N-[4-(N-naphthalen-1-ylanilino)phenyl]anilino]phenyl]-1-N,4-N,4-N-tris[4-(N-naphthalen-1-ylanilino)phenyl]benzene-1,4-diamine
CID 122607218
1-ethyl-1-naphthalen-1-ylhydrazine
CID 55252593
4-N-naphthalen-1-yl-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
CID 22218375
N-(bromomethyl)-N-methylnaphthalen-1-amine
CID 115261813
2-N,2-N,6-N,6-N-tetranaphthalen-1-ylnaphthalene-2,6-diamine
CID 159424391
N-ethenyl-N-methylnaphthalen-1-amine
CID 70602093

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetranaphthalen-1-ylhydrazine?
The IUPAC name of 1,1,2,2-tetranaphthalen-1-ylhydrazine (CID 21439529) is 1,1,2,2-tetranaphthalen-1-ylhydrazine.
What is the SMILES notation for 1,1,2,2-tetranaphthalen-1-ylhydrazine?
The canonical SMILES for 1,1,2,2-tetranaphthalen-1-ylhydrazine is c1ccc2c(N(c3cccc4ccccc34)N(c3cccc4ccccc34)c3cccc4ccccc34)cccc2c1.
What is the InChIKey of 1,1,2,2-tetranaphthalen-1-ylhydrazine?
The InChIKey is HDDDHBFDRRRUGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H28N2/c1-5-21-33-29(13-1)17-9-25-37(33)41(38-26-10-18-30-14-2-6-22-34(30)38)42(39-27-11-19-31-15-3-7-23-35(31)39)40-28-12-20-32-16-4-8-24-36(32)40/h1-28H.
What are the key properties of 1,1,2,2-tetranaphthalen-1-ylhydrazine?
1,1,2,2-tetranaphthalen-1-ylhydrazine has a molecular weight of 536.68 g/mol, XLogP of 11.19, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetranaphthalen-1-ylhydrazine is sourced from PubChem (CID 21439529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).