[4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol

C15H14N4O — CID 54249848

IUPAC[4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol
SMILESCc1ccc(-c2nnn(-c3ccc(CO)cc3)n2)cc1
InChIInChI=1S/C15H14N4O/c1-11-2-6-13(7-3-11)15-16-18-19(17-15)14-8-4-12(10-20)5-9-14/h2-9,20H,10H2,1H3
InChIKeyQVZBRXNRYAORNV-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.13
Rot. Bonds3

About [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol

[4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol (PubChem CID 54249848) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol.

Molecular Properties

Compound Name[4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol
PubChem CID54249848
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name[4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol
SMILESCc1ccc(-c2nnn(-c3ccc(CO)cc3)n2)cc1
InChIInChI=1S/C15H14N4O/c1-11-2-6-13(7-3-11)15-16-18-19(17-15)14-8-4-12(10-20)5-9-14/h2-9,20H,10H2,1H3
InChIKeyQVZBRXNRYAORNV-UHFFFAOYSA-N
XLogP2.13
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-chlorophenyl)-2-(4-methylphenyl)tetrazole
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1-[4-(5-phenyltetrazol-2-yl)phenyl]ethanol
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ethane;(4-methylphenyl)methanol;hydrate
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[4-(tetrazol-1-yl)phenyl]methanol
CID 67038028
5-(4-bromophenyl)-2-phenyltetrazole
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[4-[4-[[4-(4-methylphenyl)phenyl]methyl]phenyl]phenyl]methanol
CID 121329886
[3,5-difluoro-4-(5-phenyltetrazol-2-yl)phenyl]methanol
CID 63076359
[4-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]phenyl]methanol
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2-[5-(4-methylphenyl)tetrazol-2-yl]acetic acid
CID 701825
2-[2-[2-[2-[4-[2-(4-methoxyphenyl)tetrazol-5-yl]benzoyl]oxyethoxy]ethoxy]ethoxy]ethyl 4-[2-(4-methoxyphenyl)tetrazol-5-yl]benzoate
CID 102143178

Frequently Asked Questions

What is the IUPAC name of [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol?
The IUPAC name of [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol (CID 54249848) is [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol.
What is the SMILES notation for [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol?
The canonical SMILES for [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol is Cc1ccc(-c2nnn(-c3ccc(CO)cc3)n2)cc1.
What is the InChIKey of [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol?
The InChIKey is QVZBRXNRYAORNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-11-2-6-13(7-3-11)15-16-18-19(17-15)14-8-4-12(10-20)5-9-14/h2-9,20H,10H2,1H3.
What are the key properties of [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol?
[4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol has a molecular weight of 266.30 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[5-(4-methylphenyl)tetrazol-2-yl]phenyl]methanol is sourced from PubChem (CID 54249848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).