1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine

C4H6N10 — CID 14642846

IUPAC1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine
SMILESCn1nnc(/C=N/n2nnnc2N)n1
InChIInChI=1S/C4H6N10/c1-13-9-3(7-11-13)2-6-14-4(5)8-10-12-14/h2H,1H3,(H2,5,8,12)/b6-2+
InChIKeyVFKGYGCDCWQYHW-QHHAFSJGSA-N
MW194.16 g/mol
LogP-2.34
Rot. Bonds2

About 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine

1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine (PubChem CID 14642846) has the molecular formula C4H6N10 and a molecular weight of 194.16 g/mol. Its IUPAC name is 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine.

Molecular Properties

Compound Name1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine
PubChem CID14642846
Molecular FormulaC4H6N10
Molecular Weight194.16 g/mol
Exact Mass194.08
IUPAC Name1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine
SMILESCn1nnc(/C=N/n2nnnc2N)n1
InChIInChI=1S/C4H6N10/c1-13-9-3(7-11-13)2-6-14-4(5)8-10-12-14/h2H,1H3,(H2,5,8,12)/b6-2+
InChIKeyVFKGYGCDCWQYHW-QHHAFSJGSA-N
XLogP-2.34
TPSA125.58 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.16
LogP ≤ 5-2.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine?
The IUPAC name of 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine (CID 14642846) is 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine.
What is the SMILES notation for 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine?
The canonical SMILES for 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine is Cn1nnc(/C=N/n2nnnc2N)n1.
What is the InChIKey of 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine?
The InChIKey is VFKGYGCDCWQYHW-QHHAFSJGSA-N. The full InChI is InChI=1S/C4H6N10/c1-13-9-3(7-11-13)2-6-14-4(5)8-10-12-14/h2H,1H3,(H2,5,8,12)/b6-2+.
What are the key properties of 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine?
1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine has a molecular weight of 194.16 g/mol, XLogP of -2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-(2-methyltetrazol-5-yl)methylideneamino]tetrazol-5-amine is sourced from PubChem (CID 14642846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).