6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine

C16H16N4O — CID 90264890

IUPAC6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine
SMILESCCc1cc(OC)cc(-c2cnc3nc(N)ncc3c2)c1
InChIInChI=1S/C16H16N4O/c1-3-10-4-11(7-14(5-10)21-2)12-6-13-9-19-16(17)20-15(13)18-8-12/h4-9H,3H2,1-2H3,(H2,17,18,19,20)
InChIKeyDIIZHVBXUQELNP-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.85
Rot. Bonds3

About 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine

6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine (PubChem CID 90264890) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine
PubChem CID90264890
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine
SMILESCCc1cc(OC)cc(-c2cnc3nc(N)ncc3c2)c1
InChIInChI=1S/C16H16N4O/c1-3-10-4-11(7-14(5-10)21-2)12-6-13-9-19-16(17)20-15(13)18-8-12/h4-9H,3H2,1-2H3,(H2,17,18,19,20)
InChIKeyDIIZHVBXUQELNP-UHFFFAOYSA-N
XLogP2.85
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine (CID 90264890) is 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine is CCc1cc(OC)cc(-c2cnc3nc(N)ncc3c2)c1.
What is the InChIKey of 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine?
The InChIKey is DIIZHVBXUQELNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-3-10-4-11(7-14(5-10)21-2)12-6-13-9-19-16(17)20-15(13)18-8-12/h4-9H,3H2,1-2H3,(H2,17,18,19,20).
What are the key properties of 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine?
6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine has a molecular weight of 280.33 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-ethyl-5-methoxyphenyl)pyrido[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 90264890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).