2-[amino(tert-butyl)amino]-N,N-dimethylethanamine

C8H21N3 — CID 14519834

IUPAC2-[amino(tert-butyl)amino]-N,N-dimethylethanamine
SMILESCN(C)CCN(N)C(C)(C)C
InChIInChI=1S/C8H21N3/c1-8(2,3)11(9)7-6-10(4)5/h6-7,9H2,1-5H3
InChIKeyPNTOTPQFQBQNJK-UHFFFAOYSA-N
MW159.28 g/mol
LogP0.52
Rot. Bonds3

About 2-[amino(tert-butyl)amino]-N,N-dimethylethanamine

2-[amino(tert-butyl)amino]-N,N-dimethylethanamine (PubChem CID 14519834) has the molecular formula C8H21N3 and a molecular weight of 159.28 g/mol. Its IUPAC name is 2-[amino(tert-butyl)amino]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[amino(tert-butyl)amino]-N,N-dimethylethanamine
PubChem CID14519834
Molecular FormulaC8H21N3
Molecular Weight159.28 g/mol
Exact Mass159.17
IUPAC Name2-[amino(tert-butyl)amino]-N,N-dimethylethanamine
SMILESCN(C)CCN(N)C(C)(C)C
InChIInChI=1S/C8H21N3/c1-8(2,3)11(9)7-6-10(4)5/h6-7,9H2,1-5H3
InChIKeyPNTOTPQFQBQNJK-UHFFFAOYSA-N
XLogP0.52
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.28
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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(tert-butyl)amino]-N,N-dimethylethanamine?
The IUPAC name of 2-[amino(tert-butyl)amino]-N,N-dimethylethanamine (CID 14519834) is 2-[amino(tert-butyl)amino]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[amino(tert-butyl)amino]-N,N-dimethylethanamine?
The canonical SMILES for 2-[amino(tert-butyl)amino]-N,N-dimethylethanamine is CN(C)CCN(N)C(C)(C)C.
What is the InChIKey of 2-[amino(tert-butyl)amino]-N,N-dimethylethanamine?
The InChIKey is PNTOTPQFQBQNJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21N3/c1-8(2,3)11(9)7-6-10(4)5/h6-7,9H2,1-5H3.
What are the key properties of 2-[amino(tert-butyl)amino]-N,N-dimethylethanamine?
2-[amino(tert-butyl)amino]-N,N-dimethylethanamine has a molecular weight of 159.28 g/mol, XLogP of 0.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[amino(tert-butyl)amino]-N,N-dimethylethanamine is sourced from PubChem (CID 14519834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).