4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one

C19H18N4O2 — CID 53193790

IUPAC4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
SMILESCc1ccc(CN2C(=O)CCc3c(C)nc(-c4ccncc4)nc32)o1
InChIInChI=1S/C19H18N4O2/c1-12-3-4-15(25-12)11-23-17(24)6-5-16-13(2)21-18(22-19(16)23)14-7-9-20-10-8-14/h3-4,7-10H,5-6,11H2,1-2H3
InChIKeyVGMWGRYSLYGZBQ-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.23
Rot. Bonds3

About 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one

4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one (PubChem CID 53193790) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
PubChem CID53193790
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
SMILESCc1ccc(CN2C(=O)CCc3c(C)nc(-c4ccncc4)nc32)o1
InChIInChI=1S/C19H18N4O2/c1-12-3-4-15(25-12)11-23-17(24)6-5-16-13(2)21-18(22-19(16)23)14-7-9-20-10-8-14/h3-4,7-10H,5-6,11H2,1-2H3
InChIKeyVGMWGRYSLYGZBQ-UHFFFAOYSA-N
XLogP3.23
TPSA72.12 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one (CID 53193790) is 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one is Cc1ccc(CN2C(=O)CCc3c(C)nc(-c4ccncc4)nc32)o1.
What is the InChIKey of 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one?
The InChIKey is VGMWGRYSLYGZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-12-3-4-15(25-12)11-23-17(24)6-5-16-13(2)21-18(22-19(16)23)14-7-9-20-10-8-14/h3-4,7-10H,5-6,11H2,1-2H3.
What are the key properties of 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one?
4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one has a molecular weight of 334.38 g/mol, XLogP of 3.23, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-8-[(5-methylfuran-2-yl)methyl]-2-pyridin-4-yl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 53193790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).