N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine

C8H12N6O — CID 60966224

IUPACN-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine
SMILESCCOCCNc1cncc2nnnn12
InChIInChI=1S/C8H12N6O/c1-2-15-4-3-10-7-5-9-6-8-11-12-13-14(7)8/h5-6,10H,2-4H2,1H3
InChIKeyNGYSHPMCQRPWEH-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.03
Rot. Bonds5

About N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine

N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine (PubChem CID 60966224) has the molecular formula C8H12N6O and a molecular weight of 208.22 g/mol. Its IUPAC name is N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine
PubChem CID60966224
Molecular FormulaC8H12N6O
Molecular Weight208.22 g/mol
Exact Mass208.11
IUPAC NameN-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine
SMILESCCOCCNc1cncc2nnnn12
InChIInChI=1S/C8H12N6O/c1-2-15-4-3-10-7-5-9-6-8-11-12-13-14(7)8/h5-6,10H,2-4H2,1H3
InChIKeyNGYSHPMCQRPWEH-UHFFFAOYSA-N
XLogP-0.03
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine?
The IUPAC name of N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine (CID 60966224) is N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine.
What is the SMILES notation for N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine?
The canonical SMILES for N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine is CCOCCNc1cncc2nnnn12.
What is the InChIKey of N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine?
The InChIKey is NGYSHPMCQRPWEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N6O/c1-2-15-4-3-10-7-5-9-6-8-11-12-13-14(7)8/h5-6,10H,2-4H2,1H3.
What are the key properties of N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine?
N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine has a molecular weight of 208.22 g/mol, XLogP of -0.03, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine is sourced from PubChem (CID 60966224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).