3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine

C12H21N3 — CID 106659375

IUPAC3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine
SMILESCCCCc1nc(C)c(C)nc1NCC
InChIInChI=1S/C12H21N3/c1-5-7-8-11-12(13-6-2)15-10(4)9(3)14-11/h5-8H2,1-4H3,(H,13,15)
InChIKeyMMFLMOXBASAHBF-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.87
Rot. Bonds5

About 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine

3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine (PubChem CID 106659375) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine.

Molecular Properties

Compound Name3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine
PubChem CID106659375
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine
SMILESCCCCc1nc(C)c(C)nc1NCC
InChIInChI=1S/C12H21N3/c1-5-7-8-11-12(13-6-2)15-10(4)9(3)14-11/h5-8H2,1-4H3,(H,13,15)
InChIKeyMMFLMOXBASAHBF-UHFFFAOYSA-N
XLogP2.87
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-butyl-N-ethyl-4,5-dimethylpyridazin-3-amine
CID 106659331
6-butyl-3,5-dichloro-N-ethylpyridin-2-amine
CID 106659441
N-ethyl-5,6-dimethyl-3-(1,3-thiazol-2-ylmethyl)pyrazin-2-amine
CID 79820460
3-(butylamino)-5,6-dimethylpyrazine-2-carbonitrile
CID 134914335
4-N,5-dibutyl-6-methylpyrimidine-2,4-diamine
CID 135271003
3,4-dibutyl-1-methylisoquinoline
CID 71619287
2-butyl-6-tert-butyl-N-ethyl-5-iodopyrimidin-4-amine
CID 79411802
6-butyl-N,4,5-trimethylpyridazin-3-amine
CID 106659403
3,5-dichloro-N-ethyl-6-methylpyridin-2-amine
CID 102753093
2-N,8-dibutyl-6-N-ethyl-4-N-methylpyrimido[5,4-d]pyrimidine-2,4,6-triamine
CID 148836551
2,3-dibutylquinoxaline
CID 14641798
4-butyl-5-propyl-2H-triazole
CID 69382239

Frequently Asked Questions

What is the IUPAC name of 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine?
The IUPAC name of 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine (CID 106659375) is 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine.
What is the SMILES notation for 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine?
The canonical SMILES for 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine is CCCCc1nc(C)c(C)nc1NCC.
What is the InChIKey of 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine?
The InChIKey is MMFLMOXBASAHBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-5-7-8-11-12(13-6-2)15-10(4)9(3)14-11/h5-8H2,1-4H3,(H,13,15).
What are the key properties of 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine?
3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine has a molecular weight of 207.32 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine is sourced from PubChem (CID 106659375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).