N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine

C10H17N7 — CID 62586413

IUPACN,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine
SMILESCCNCCN(CC)c1cncc2nnnn12
InChIInChI=1S/C10H17N7/c1-3-11-5-6-16(4-2)10-8-12-7-9-13-14-15-17(9)10/h7-8,11H,3-6H2,1-2H3
InChIKeyMDXJDGZEASSSFN-UHFFFAOYSA-N
MW235.29 g/mol
LogP-0.04
Rot. Bonds6

About N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine

N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine (PubChem CID 62586413) has the molecular formula C10H17N7 and a molecular weight of 235.29 g/mol. Its IUPAC name is N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine
PubChem CID62586413
Molecular FormulaC10H17N7
Molecular Weight235.29 g/mol
Exact Mass235.15
IUPAC NameN,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine
SMILESCCNCCN(CC)c1cncc2nnnn12
InChIInChI=1S/C10H17N7/c1-3-11-5-6-16(4-2)10-8-12-7-9-13-14-15-17(9)10/h7-8,11H,3-6H2,1-2H3
InChIKeyMDXJDGZEASSSFN-UHFFFAOYSA-N
XLogP-0.04
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzyl-N-(2-bromoethyl)tetrazolo[1,5-a]pyrazin-5-amine
CID 80674289
methyl 2-[methyl(tetrazolo[1,5-a]pyrazin-5-yl)amino]acetate
CID 62004531
N-propyl-3-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine
CID 63200003
N-(2-methoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine
CID 60980965
N-propyl-1-(tetrazolo[1,5-a]pyrazin-5-yl)butan-2-amine
CID 63202265
N-methyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine
CID 62659503
methyl 2-methyl-3-[methyl(tetrazolo[1,5-a]pyrazin-5-yl)amino]propanoate
CID 62006910
2-[1-[methyl(tetrazolo[1,5-a]pyrazin-5-yl)amino]cyclohexyl]acetic acid
CID 65242973
N,N'-diethyl-N'-(5-fluoropyrimidin-2-yl)ethane-1,2-diamine
CID 104606633
N-(2-bromo-3-methoxypropyl)-N-methyltetrazolo[1,5-a]pyrazin-5-amine
CID 80674800
N'-(3-bromo-4-pyridinyl)-N,N'-diethylethane-1,2-diamine
CID 104779301
1-(tetrazolo[1,5-a]pyrazin-5-yl)propan-2-amine
CID 63196883

Frequently Asked Questions

What is the IUPAC name of N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine?
The IUPAC name of N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine (CID 62586413) is N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine.
What is the SMILES notation for N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine?
The canonical SMILES for N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine is CCNCCN(CC)c1cncc2nnnn12.
What is the InChIKey of N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine?
The InChIKey is MDXJDGZEASSSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N7/c1-3-11-5-6-16(4-2)10-8-12-7-9-13-14-15-17(9)10/h7-8,11H,3-6H2,1-2H3.
What are the key properties of N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine?
N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine has a molecular weight of 235.29 g/mol, XLogP of -0.04, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-diethyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine is sourced from PubChem (CID 62586413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).