2-(1-phenyltetrazol-5-yl)ethanamine

C9H11N5 — CID 64981210

IUPAC2-(1-phenyltetrazol-5-yl)ethanamine
SMILESNCCc1nnnn1-c1ccccc1
InChIInChI=1S/C9H11N5/c10-7-6-9-11-12-13-14(9)8-4-2-1-3-5-8/h1-5H,6-7,10H2
InChIKeyGVVYZCUZGMLYPR-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.16
Rot. Bonds3

About 2-(1-phenyltetrazol-5-yl)ethanamine

2-(1-phenyltetrazol-5-yl)ethanamine (PubChem CID 64981210) has the molecular formula C9H11N5 and a molecular weight of 189.22 g/mol. Its IUPAC name is 2-(1-phenyltetrazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(1-phenyltetrazol-5-yl)ethanamine
PubChem CID64981210
Molecular FormulaC9H11N5
Molecular Weight189.22 g/mol
Exact Mass189.10
IUPAC Name2-(1-phenyltetrazol-5-yl)ethanamine
SMILESNCCc1nnnn1-c1ccccc1
InChIInChI=1S/C9H11N5/c10-7-6-9-11-12-13-14(9)8-4-2-1-3-5-8/h1-5H,6-7,10H2
InChIKeyGVVYZCUZGMLYPR-UHFFFAOYSA-N
XLogP0.16
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-phenyl-5-[(1-phenyltetrazol-5-yl)methyl]tetrazole
CID 3090521
5-butyl-1-phenyltetrazole
CID 69031432
4-(1-phenyltetrazol-5-yl)butanethioamide
CID 54231747
dimethyl-[(1-phenyltetrazol-5-yl)methyl]azanium
CID 7303876
ethyl 4-[5-(2-aminoethyl)tetrazol-1-yl]benzoate
CID 82227969
1-cyclopropyl-2-[2-(1-phenyltetrazol-5-yl)ethyl]guanidine;hydroiodide
CID 120770597
3-[5-(3-aminopropyl)tetrazol-1-yl]phenol
CID 82228068
1-(1-phenyltetrazol-5-yl)hexan-3-ol
CID 79422541
2-methyl-2-[(1-phenyltetrazol-5-yl)methyl]butan-1-amine
CID 62725113
5-[2-(2-methyloxiran-2-yl)ethyl]-1-phenyltetrazole
CID 87852403
[4-[(1-phenyltetrazol-5-yl)methoxy]phenyl]methanamine
CID 106484887
2-(2-phenyl-1,2,4-triazol-3-yl)ethanamine
CID 84661566

Frequently Asked Questions

What is the IUPAC name of 2-(1-phenyltetrazol-5-yl)ethanamine?
The IUPAC name of 2-(1-phenyltetrazol-5-yl)ethanamine (CID 64981210) is 2-(1-phenyltetrazol-5-yl)ethanamine.
What is the SMILES notation for 2-(1-phenyltetrazol-5-yl)ethanamine?
The canonical SMILES for 2-(1-phenyltetrazol-5-yl)ethanamine is NCCc1nnnn1-c1ccccc1.
What is the InChIKey of 2-(1-phenyltetrazol-5-yl)ethanamine?
The InChIKey is GVVYZCUZGMLYPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5/c10-7-6-9-11-12-13-14(9)8-4-2-1-3-5-8/h1-5H,6-7,10H2.
What are the key properties of 2-(1-phenyltetrazol-5-yl)ethanamine?
2-(1-phenyltetrazol-5-yl)ethanamine has a molecular weight of 189.22 g/mol, XLogP of 0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenyltetrazol-5-yl)ethanamine is sourced from PubChem (CID 64981210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).