2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one

C8H8N4O — CID 44713836

IUPAC2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one
SMILESCc1nc(N)nc2[nH]c(=O)ccc12
InChIInChI=1S/C8H8N4O/c1-4-5-2-3-6(13)11-7(5)12-8(9)10-4/h2-3H,1H3,(H3,9,10,11,12,13)
InChIKeyMYGQIIDJBYQZKZ-UHFFFAOYSA-N
MW176.18 g/mol
LogP0.21
Rot. Bonds

About 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one

2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one (PubChem CID 44713836) has the molecular formula C8H8N4O and a molecular weight of 176.18 g/mol. Its IUPAC name is 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one
PubChem CID44713836
Molecular FormulaC8H8N4O
Molecular Weight176.18 g/mol
Exact Mass176.07
IUPAC Name2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one
SMILESCc1nc(N)nc2[nH]c(=O)ccc12
InChIInChI=1S/C8H8N4O/c1-4-5-2-3-6(13)11-7(5)12-8(9)10-4/h2-3H,1H3,(H3,9,10,11,12,13)
InChIKeyMYGQIIDJBYQZKZ-UHFFFAOYSA-N
XLogP0.21
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.18
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one (CID 44713836) is 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one is Cc1nc(N)nc2[nH]c(=O)ccc12.
What is the InChIKey of 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is MYGQIIDJBYQZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O/c1-4-5-2-3-6(13)11-7(5)12-8(9)10-4/h2-3H,1H3,(H3,9,10,11,12,13).
What are the key properties of 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one?
2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 176.18 g/mol, XLogP of 0.21, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-8H-pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 44713836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).