3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine

C10H18N4O — CID 83179069

IUPAC3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine
SMILESCCOc1cncc(NC(C)CCN)n1
InChIInChI=1S/C10H18N4O/c1-3-15-10-7-12-6-9(14-10)13-8(2)4-5-11/h6-8H,3-5,11H2,1-2H3,(H,13,14)
InChIKeyJCMXIGVSSCOTCE-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.02
Rot. Bonds6

About 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine

3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine (PubChem CID 83179069) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine.

Molecular Properties

Compound Name3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine
PubChem CID83179069
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine
SMILESCCOc1cncc(NC(C)CCN)n1
InChIInChI=1S/C10H18N4O/c1-3-15-10-7-12-6-9(14-10)13-8(2)4-5-11/h6-8H,3-5,11H2,1-2H3,(H,13,14)
InChIKeyJCMXIGVSSCOTCE-UHFFFAOYSA-N
XLogP1.02
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethoxy-N-(4-methylsulfonylbutan-2-yl)pyrazin-2-amine
CID 133375005
2-N-(6-ethoxypyrazin-2-yl)-3-methoxypropane-1,2-diamine
CID 106182379
N'-(6-ethoxypyrazin-2-yl)pentane-1,5-diamine
CID 107323521
4-methoxy-3-N-(6-propoxypyrazin-2-yl)butane-1,3-diamine
CID 114151042
2-methyl-3-N-(6-propoxypyrazin-2-yl)butane-1,3-diamine
CID 113485176
N-[3-(2-aminoethoxy)propyl]-6-ethoxypyrazin-2-amine
CID 106308549
N-(6-ethoxypyrazin-2-yl)-2,2-dimethylpentane-1,5-diamine
CID 114149316
(6-ethoxypyrazin-2-yl)thiourea
CID 90714777
2-N-pentan-2-ylpyrazine-2,6-diamine
CID 78988938
(6-ethoxypyrazin-2-yl)methanamine
CID 66450583
(2R,4R)-5-[(6-ethoxypyrazin-2-yl)amino]-4-methylpentan-2-ol
CID 124741988
N-(1-chloro-3-phenylpropan-2-yl)-6-ethoxypyrazin-2-amine
CID 65029274

Frequently Asked Questions

What is the IUPAC name of 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine?
The IUPAC name of 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine (CID 83179069) is 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine.
What is the SMILES notation for 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine?
The canonical SMILES for 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine is CCOc1cncc(NC(C)CCN)n1.
What is the InChIKey of 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine?
The InChIKey is JCMXIGVSSCOTCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-3-15-10-7-12-6-9(14-10)13-8(2)4-5-11/h6-8H,3-5,11H2,1-2H3,(H,13,14).
What are the key properties of 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine?
3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine has a molecular weight of 210.28 g/mol, XLogP of 1.02, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(6-ethoxypyrazin-2-yl)butane-1,3-diamine is sourced from PubChem (CID 83179069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).