(2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide

C13H16N4O2 — CID 39781689

IUPAC(2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide
SMILESCC(C)C[C@H](C(N)=O)n1cnc2ncccc2c1=O
InChIInChI=1S/C13H16N4O2/c1-8(2)6-10(11(14)18)17-7-16-12-9(13(17)19)4-3-5-15-12/h3-5,7-8,10H,6H2,1-2H3,(H2,14,18)/t10-/m1/s1
InChIKeyJFVGGMNTZAFBIS-SNVBAGLBSA-N
MW260.30 g/mol
LogP0.86
Rot. Bonds4

About (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide

(2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide (PubChem CID 39781689) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide.

Molecular Properties

Compound Name(2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide
PubChem CID39781689
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name(2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide
SMILESCC(C)C[C@H](C(N)=O)n1cnc2ncccc2c1=O
InChIInChI=1S/C13H16N4O2/c1-8(2)6-10(11(14)18)17-7-16-12-9(13(17)19)4-3-5-15-12/h3-5,7-8,10H,6H2,1-2H3,(H2,14,18)/t10-/m1/s1
InChIKeyJFVGGMNTZAFBIS-SNVBAGLBSA-N
XLogP0.86
TPSA90.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide?
The IUPAC name of (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide (CID 39781689) is (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide.
What is the SMILES notation for (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide?
The canonical SMILES for (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide is CC(C)C[C@H](C(N)=O)n1cnc2ncccc2c1=O.
What is the InChIKey of (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide?
The InChIKey is JFVGGMNTZAFBIS-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-8(2)6-10(11(14)18)17-7-16-12-9(13(17)19)4-3-5-15-12/h3-5,7-8,10H,6H2,1-2H3,(H2,14,18)/t10-/m1/s1.
What are the key properties of (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide?
(2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide has a molecular weight of 260.30 g/mol, XLogP of 0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-methyl-2-(4-oxopyrido[2,3-d]pyrimidin-3-yl)pentanamide is sourced from PubChem (CID 39781689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).