3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine

C12H14N4O — CID 11458873

IUPAC3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine
SMILESCCOc1nccnc1Nc1cccc(C)n1
InChIInChI=1S/C12H14N4O/c1-3-17-12-11(13-7-8-14-12)16-10-6-4-5-9(2)15-10/h4-8H,3H2,1-2H3,(H,13,15,16)
InChIKeyBDJSRYXOYVCWHM-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.32
Rot. Bonds4

About 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine

3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine (PubChem CID 11458873) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine
PubChem CID11458873
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine
SMILESCCOc1nccnc1Nc1cccc(C)n1
InChIInChI=1S/C12H14N4O/c1-3-17-12-11(13-7-8-14-12)16-10-6-4-5-9(2)15-10/h4-8H,3H2,1-2H3,(H,13,15,16)
InChIKeyBDJSRYXOYVCWHM-UHFFFAOYSA-N
XLogP2.32
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine?
The IUPAC name of 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine (CID 11458873) is 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine.
What is the SMILES notation for 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine?
The canonical SMILES for 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine is CCOc1nccnc1Nc1cccc(C)n1.
What is the InChIKey of 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine?
The InChIKey is BDJSRYXOYVCWHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-3-17-12-11(13-7-8-14-12)16-10-6-4-5-9(2)15-10/h4-8H,3H2,1-2H3,(H,13,15,16).
What are the key properties of 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine?
3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine has a molecular weight of 230.27 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(6-methyl-2-pyridinyl)pyrazin-2-amine is sourced from PubChem (CID 11458873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).