5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine

C15H15N5O — CID 143123065

IUPAC5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine
SMILESCCc1nccc(-c2cc(N)c(N)nc2-c2ccco2)n1
InChIInChI=1S/C15H15N5O/c1-2-13-18-6-5-11(19-13)9-8-10(16)15(17)20-14(9)12-4-3-7-21-12/h3-8H,2,16H2,1H3,(H2,17,20)
InChIKeyIVYWCXNWHMNGRI-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.53
Rot. Bonds3

About 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine

5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine (PubChem CID 143123065) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine.

Molecular Properties

Compound Name5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine
PubChem CID143123065
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine
SMILESCCc1nccc(-c2cc(N)c(N)nc2-c2ccco2)n1
InChIInChI=1S/C15H15N5O/c1-2-13-18-6-5-11(19-13)9-8-10(16)15(17)20-14(9)12-4-3-7-21-12/h3-8H,2,16H2,1H3,(H2,17,20)
InChIKeyIVYWCXNWHMNGRI-UHFFFAOYSA-N
XLogP2.53
TPSA103.85 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine?
The IUPAC name of 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine (CID 143123065) is 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine.
What is the SMILES notation for 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine?
The canonical SMILES for 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine is CCc1nccc(-c2cc(N)c(N)nc2-c2ccco2)n1.
What is the InChIKey of 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine?
The InChIKey is IVYWCXNWHMNGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-2-13-18-6-5-11(19-13)9-8-10(16)15(17)20-14(9)12-4-3-7-21-12/h3-8H,2,16H2,1H3,(H2,17,20).
What are the key properties of 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine?
5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine has a molecular weight of 281.32 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylpyrimidin-4-yl)-6-(furan-2-yl)pyridine-2,3-diamine is sourced from PubChem (CID 143123065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).