6-butoxy-N-ethylpyrazin-2-amine

C10H17N3O — CID 80865504

IUPAC6-butoxy-N-ethylpyrazin-2-amine
SMILESCCCCOc1cncc(NCC)n1
InChIInChI=1S/C10H17N3O/c1-3-5-6-14-10-8-11-7-9(13-10)12-4-2/h7-8H,3-6H2,1-2H3,(H,12,13)
InChIKeyBVVLWELAVVPFSB-UHFFFAOYSA-N
MW195.27 g/mol
LogP2.09
Rot. Bonds6

About 6-butoxy-N-ethylpyrazin-2-amine

6-butoxy-N-ethylpyrazin-2-amine (PubChem CID 80865504) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 6-butoxy-N-ethylpyrazin-2-amine.

Molecular Properties

Compound Name6-butoxy-N-ethylpyrazin-2-amine
PubChem CID80865504
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name6-butoxy-N-ethylpyrazin-2-amine
SMILESCCCCOc1cncc(NCC)n1
InChIInChI=1S/C10H17N3O/c1-3-5-6-14-10-8-11-7-9(13-10)12-4-2/h7-8H,3-6H2,1-2H3,(H,12,13)
InChIKeyBVVLWELAVVPFSB-UHFFFAOYSA-N
XLogP2.09
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-6-methoxypyrazin-2-amine
CID 21419063
2-N-(2-butoxyethyl)-6-N-ethylpyrazine-2,6-diamine
CID 78918192
N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine
CID 80865438
6-butoxy-N-ethylpyridin-2-amine
CID 80867318
N-ethyl-6-(2-pyridin-2-ylethoxy)pyrazin-2-amine
CID 80865109
N-ethyl-6-(2,2,3,3,3-pentafluoropropoxy)pyrazin-2-amine
CID 80878301
N-ethyl-6-octan-2-yloxypyrazin-2-amine
CID 80861950
6-[2-(3-methoxypropoxy)ethoxy]-N-propylpyrazin-2-amine
CID 103176484
N-ethyl-6-(4-methylcyclohexyl)oxypyrazin-2-amine
CID 80858436
N-(2-chloro-4,4-dimethylpentyl)-6-propoxypyrazin-2-amine
CID 107156141
6-(2-cyclobutylethoxy)-N-propylpyrazin-2-amine
CID 114158245
N-[2-(4-aminopyrazol-1-yl)ethyl]-6-propoxypyrazin-2-amine
CID 115320144

Frequently Asked Questions

What is the IUPAC name of 6-butoxy-N-ethylpyrazin-2-amine?
The IUPAC name of 6-butoxy-N-ethylpyrazin-2-amine (CID 80865504) is 6-butoxy-N-ethylpyrazin-2-amine.
What is the SMILES notation for 6-butoxy-N-ethylpyrazin-2-amine?
The canonical SMILES for 6-butoxy-N-ethylpyrazin-2-amine is CCCCOc1cncc(NCC)n1.
What is the InChIKey of 6-butoxy-N-ethylpyrazin-2-amine?
The InChIKey is BVVLWELAVVPFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-3-5-6-14-10-8-11-7-9(13-10)12-4-2/h7-8H,3-6H2,1-2H3,(H,12,13).
What are the key properties of 6-butoxy-N-ethylpyrazin-2-amine?
6-butoxy-N-ethylpyrazin-2-amine has a molecular weight of 195.27 g/mol, XLogP of 2.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butoxy-N-ethylpyrazin-2-amine is sourced from PubChem (CID 80865504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).