2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine

C6H17N7 — CID 155130424

IUPAC2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine
SMILESCN(C)CCN(N)C1=NNN(C)N1
InChIInChI=1S/C6H17N7/c1-11(2)4-5-13(7)6-8-10-12(3)9-6/h10H,4-5,7H2,1-3H3,(H,8,9)
InChIKeySUDFMHZXGHVKCZ-UHFFFAOYSA-N
MW187.25 g/mol
LogP-2.05
Rot. Bonds3

About 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine

2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine (PubChem CID 155130424) has the molecular formula C6H17N7 and a molecular weight of 187.25 g/mol. Its IUPAC name is 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine
PubChem CID155130424
Molecular FormulaC6H17N7
Molecular Weight187.25 g/mol
Exact Mass187.15
IUPAC Name2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine
SMILESCN(C)CCN(N)C1=NNN(C)N1
InChIInChI=1S/C6H17N7/c1-11(2)4-5-13(7)6-8-10-12(3)9-6/h10H,4-5,7H2,1-3H3,(H,8,9)
InChIKeySUDFMHZXGHVKCZ-UHFFFAOYSA-N
XLogP-2.05
TPSA72.16 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 5-2.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine?
The IUPAC name of 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine (CID 155130424) is 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine?
The canonical SMILES for 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine is CN(C)CCN(N)C1=NNN(C)N1.
What is the InChIKey of 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine?
The InChIKey is SUDFMHZXGHVKCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17N7/c1-11(2)4-5-13(7)6-8-10-12(3)9-6/h10H,4-5,7H2,1-3H3,(H,8,9).
What are the key properties of 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine?
2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine has a molecular weight of 187.25 g/mol, XLogP of -2.05, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[amino-(2-methyl-1,3-dihydrotetrazol-5-yl)amino]-N,N-dimethylethanamine is sourced from PubChem (CID 155130424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).