(7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one

C14H13FN4O — CID 57424852

About (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one

(7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one (PubChem CID 57424852) has the molecular formula C14H13FN4O and a molecular weight of 272.28 g/mol. Its IUPAC name is (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one.

Molecular Properties

• Compound Name: (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
• PubChem CID: 57424852
• Molecular Formula: C14H13FN4O
• Molecular Weight: 272.28 g/mol
• Exact Mass: 272.11
• IUPAC Name: (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
• SMILES: Cc1nc(N)nc2c1C(=O)N[C@@H](c1ccc(F)cc1)C2
• InChI: InChI=1S/C14H13FN4O/c1-7-12-11(19-14(16)17-7)6-10(18-13(12)20)8-2-4-9(15)5-3-8/h2-5,10H,6H2,1H3,(H,18,20)(H2,16,17,19)/t10-/m1/s1
• InChIKey: GTSUIIPROYHHQL-SNVBAGLBSA-N
• XLogP: 1.53
• TPSA: 80.90 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 1
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	272.28
LogP ≤ 5	1.53
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?

The IUPAC name of (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one (CID 57424852) is (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one.

What is the SMILES notation for (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?

The canonical SMILES for (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one is Cc1nc(N)nc2c1C(=O)N[C@@H](c1ccc(F)cc1)C2.

What is the InChIKey of (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?

The InChIKey is GTSUIIPROYHHQL-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H13FN4O/c1-7-12-11(19-14(16)17-7)6-10(18-13(12)20)8-2-4-9(15)5-3-8/h2-5,10H,6H2,1H3,(H,18,20)(H2,16,17,19)/t10-/m1/s1.

What are the key properties of (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one?

(7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one has a molecular weight of 272.28 g/mol, XLogP of 1.53, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (7R)-2-amino-7-(4-fluorophenyl)-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one is sourced from PubChem (CID 57424852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).