N,N-dibutyl-3,6-dimethylpyrazin-2-amine

C14H25N3 — CID 518401

IUPACN,N-dibutyl-3,6-dimethylpyrazin-2-amine
SMILESCCCCN(CCCC)c1nc(C)cnc1C
InChIInChI=1S/C14H25N3/c1-5-7-9-17(10-8-6-2)14-13(4)15-11-12(3)16-14/h11H,5-10H2,1-4H3
InChIKeyHFNGWNNJLWDPHQ-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.50
Rot. Bonds7

About N,N-dibutyl-3,6-dimethylpyrazin-2-amine

N,N-dibutyl-3,6-dimethylpyrazin-2-amine (PubChem CID 518401) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N,N-dibutyl-3,6-dimethylpyrazin-2-amine.

Molecular Properties

Compound NameN,N-dibutyl-3,6-dimethylpyrazin-2-amine
PubChem CID518401
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN,N-dibutyl-3,6-dimethylpyrazin-2-amine
SMILESCCCCN(CCCC)c1nc(C)cnc1C
InChIInChI=1S/C14H25N3/c1-5-7-9-17(10-8-6-2)14-13(4)15-11-12(3)16-14/h11H,5-10H2,1-4H3
InChIKeyHFNGWNNJLWDPHQ-UHFFFAOYSA-N
XLogP3.50
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-3,6-dimethylpyrazin-2-amine?
The IUPAC name of N,N-dibutyl-3,6-dimethylpyrazin-2-amine (CID 518401) is N,N-dibutyl-3,6-dimethylpyrazin-2-amine.
What is the SMILES notation for N,N-dibutyl-3,6-dimethylpyrazin-2-amine?
The canonical SMILES for N,N-dibutyl-3,6-dimethylpyrazin-2-amine is CCCCN(CCCC)c1nc(C)cnc1C.
What is the InChIKey of N,N-dibutyl-3,6-dimethylpyrazin-2-amine?
The InChIKey is HFNGWNNJLWDPHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-5-7-9-17(10-8-6-2)14-13(4)15-11-12(3)16-14/h11H,5-10H2,1-4H3.
What are the key properties of N,N-dibutyl-3,6-dimethylpyrazin-2-amine?
N,N-dibutyl-3,6-dimethylpyrazin-2-amine has a molecular weight of 235.37 g/mol, XLogP of 3.50, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-3,6-dimethylpyrazin-2-amine is sourced from PubChem (CID 518401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).