5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine

C19H16N4O2 — CID 19257003

IUPAC5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCCOc1ccc(-c2cc(-c3ccco3)nc3ncnc(N)c23)cc1
InChIInChI=1S/C19H16N4O2/c1-2-24-13-7-5-12(6-8-13)14-10-15(16-4-3-9-25-16)23-19-17(14)18(20)21-11-22-19/h3-11H,2H2,1H3,(H2,20,21,22,23)
InChIKeyCFZNVWQYNHWNSW-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.93
Rot. Bonds4

About 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine

5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 19257003) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine
PubChem CID19257003
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC Name5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCCOc1ccc(-c2cc(-c3ccco3)nc3ncnc(N)c23)cc1
InChIInChI=1S/C19H16N4O2/c1-2-24-13-7-5-12(6-8-13)14-10-15(16-4-3-9-25-16)23-19-17(14)18(20)21-11-22-19/h3-11H,2H2,1H3,(H2,20,21,22,23)
InChIKeyCFZNVWQYNHWNSW-UHFFFAOYSA-N
XLogP3.93
TPSA87.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine (CID 19257003) is 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine is CCOc1ccc(-c2cc(-c3ccco3)nc3ncnc(N)c23)cc1.
What is the InChIKey of 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is CFZNVWQYNHWNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c1-2-24-13-7-5-12(6-8-13)14-10-15(16-4-3-9-25-16)23-19-17(14)18(20)21-11-22-19/h3-11H,2H2,1H3,(H2,20,21,22,23).
What are the key properties of 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine?
5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 332.36 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxyphenyl)-7-(furan-2-yl)pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 19257003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).