1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole

C18H14N4 — CID 12552784

IUPAC1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole
SMILESCc1ccc2ccccc2c1-n1nnnc1-c1ccccc1
InChIInChI=1S/C18H14N4/c1-13-11-12-14-7-5-6-10-16(14)17(13)22-18(19-20-21-22)15-8-3-2-4-9-15/h2-12H,1H3
InChIKeyQGXMGTLRCDBGMX-UHFFFAOYSA-N
MW286.34 g/mol
LogP3.79
Rot. Bonds2

About 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole

1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole (PubChem CID 12552784) has the molecular formula C18H14N4 and a molecular weight of 286.34 g/mol. Its IUPAC name is 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole.

Molecular Properties

Compound Name1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole
PubChem CID12552784
Molecular FormulaC18H14N4
Molecular Weight286.34 g/mol
Exact Mass286.12
IUPAC Name1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole
SMILESCc1ccc2ccccc2c1-n1nnnc1-c1ccccc1
InChIInChI=1S/C18H14N4/c1-13-11-12-14-7-5-6-10-16(14)17(13)22-18(19-20-21-22)15-8-3-2-4-9-15/h2-12H,1H3
InChIKeyQGXMGTLRCDBGMX-UHFFFAOYSA-N
XLogP3.79
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenyl-3-(5-phenyltetrazol-1-yl)-1H-indole
CID 118908819
4,5-dimethyl-2-(5-phenyltetrazol-1-yl)aniline
CID 62098270
9-[5-(4-nitrophenyl)tetrazol-1-yl]acridine
CID 101223337
1-[[2-[1-(2,6-dimethylphenyl)tetrazol-5-yl]naphthalen-1-yl]methyl]-4-(3-phenylprop-2-enyl)piperazine
CID 68694569
2-(2-methylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine
CID 166656403
1,5-diphenyltetrazole;2-methyl-1,3-thiazole
CID 175112675
1-(3-chlorophenyl)-5-phenyltetrazole
CID 854387
4-[1-(2-methylphenyl)tetrazol-5-yl]aniline
CID 61353402
5-phenyltetrazolo[1,5-c]quinazoline
CID 613079
1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene
CID 11739441
2-methyl-1-(2-phenylphenyl)naphthalene
CID 102027516
4-(5-naphthalen-2-yltetrazol-1-yl)pyridine
CID 54581363

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole?
The IUPAC name of 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole (CID 12552784) is 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole.
What is the SMILES notation for 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole?
The canonical SMILES for 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole is Cc1ccc2ccccc2c1-n1nnnc1-c1ccccc1.
What is the InChIKey of 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole?
The InChIKey is QGXMGTLRCDBGMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4/c1-13-11-12-14-7-5-6-10-16(14)17(13)22-18(19-20-21-22)15-8-3-2-4-9-15/h2-12H,1H3.
What are the key properties of 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole?
1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole has a molecular weight of 286.34 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylnaphthalen-1-yl)-5-phenyltetrazole is sourced from PubChem (CID 12552784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).