2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one

C10H12N4O — CID 18374883

IUPAC2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one
SMILESCCNc1ncc2ccc(=O)n(C)c2n1
InChIInChI=1S/C10H12N4O/c1-3-11-10-12-6-7-4-5-8(15)14(2)9(7)13-10/h4-6H,3H2,1-2H3,(H,11,12,13)
InChIKeyDCIHPOIFFJRFKS-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.76
Rot. Bonds2

About 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one

2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one (PubChem CID 18374883) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one
PubChem CID18374883
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one
SMILESCCNc1ncc2ccc(=O)n(C)c2n1
InChIInChI=1S/C10H12N4O/c1-3-11-10-12-6-7-4-5-8(15)14(2)9(7)13-10/h4-6H,3H2,1-2H3,(H,11,12,13)
InChIKeyDCIHPOIFFJRFKS-UHFFFAOYSA-N
XLogP0.76
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one (CID 18374883) is 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one is CCNc1ncc2ccc(=O)n(C)c2n1.
What is the InChIKey of 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one?
The InChIKey is DCIHPOIFFJRFKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-3-11-10-12-6-7-4-5-8(15)14(2)9(7)13-10/h4-6H,3H2,1-2H3,(H,11,12,13).
What are the key properties of 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one?
2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one has a molecular weight of 204.23 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 18374883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).