6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine

C15H26N4 — CID 66457774

IUPAC6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine
SMILESC=C(C)CN(CC)c1cncc(CNC(C)(C)C)n1
InChIInChI=1S/C15H26N4/c1-7-19(11-12(2)3)14-10-16-8-13(18-14)9-17-15(4,5)6/h8,10,17H,2,7,9,11H2,1,3-6H3
InChIKeyNHBZQFNSUKJKNB-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.77
Rot. Bonds6

About 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine

6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine (PubChem CID 66457774) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine
PubChem CID66457774
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine
SMILESC=C(C)CN(CC)c1cncc(CNC(C)(C)C)n1
InChIInChI=1S/C15H26N4/c1-7-19(11-12(2)3)14-10-16-8-13(18-14)9-17-15(4,5)6/h8,10,17H,2,7,9,11H2,1,3-6H3
InChIKeyNHBZQFNSUKJKNB-UHFFFAOYSA-N
XLogP2.77
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine?
The IUPAC name of 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine (CID 66457774) is 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine.
What is the SMILES notation for 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine?
The canonical SMILES for 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine is C=C(C)CN(CC)c1cncc(CNC(C)(C)C)n1.
What is the InChIKey of 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine?
The InChIKey is NHBZQFNSUKJKNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-7-19(11-12(2)3)14-10-16-8-13(18-14)9-17-15(4,5)6/h8,10,17H,2,7,9,11H2,1,3-6H3.
What are the key properties of 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine?
6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine has a molecular weight of 262.40 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine is sourced from PubChem (CID 66457774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).