5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione

C12H15N3O3 — CID 18567251

IUPAC5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)c2c(OC)ccnc2n(C)c1=O
InChIInChI=1S/C12H15N3O3/c1-4-7-15-11(16)9-8(18-3)5-6-13-10(9)14(2)12(15)17/h5-6H,4,7H2,1-3H3
InChIKeyBRARZTPKNHASLB-UHFFFAOYSA-N
MW249.27 g/mol
LogP0.51
Rot. Bonds3

About 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione

5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 18567251) has the molecular formula C12H15N3O3 and a molecular weight of 249.27 g/mol. Its IUPAC name is 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID18567251
Molecular FormulaC12H15N3O3
Molecular Weight249.27 g/mol
Exact Mass249.11
IUPAC Name5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)c2c(OC)ccnc2n(C)c1=O
InChIInChI=1S/C12H15N3O3/c1-4-7-15-11(16)9-8(18-3)5-6-13-10(9)14(2)12(15)17/h5-6H,4,7H2,1-3H3
InChIKeyBRARZTPKNHASLB-UHFFFAOYSA-N
XLogP0.51
TPSA66.12 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 50.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-3-(3-methylbutyl)-5-propoxypyrido[2,3-d]pyrimidine-2,4-dione
CID 16801618
1-methyl-5-propoxy-3-(2-pyrrolidin-1-ylethyl)pyrido[2,3-d]pyrimidine-2,4-dione
CID 16801624
1-methyl-5-propoxy-3-prop-2-ynylpyrido[2,3-d]pyrimidine-2,4-dione
CID 18567458
5-ethoxy-1-methyl-3-prop-2-ynylpyrido[2,3-d]pyrimidine-2,4-dione
CID 18567379
5-methoxy-1-methyl-3-[[3-(trifluoromethyl)phenyl]methyl]pyrido[2,3-d]pyrimidine-2,4-dione
CID 18567268
2-(5-methoxy-1-methyl-2,4-dioxopyrido[2,3-d]pyrimidin-3-yl)-N-[(4-methylphenyl)methyl]acetamide
CID 26841382
N-(2,5-dimethylphenyl)-2-(5-methoxy-1-methyl-2,4-dioxopyrido[2,3-d]pyrimidin-3-yl)acetamide
CID 26841363
2-(5-ethoxy-1-methyl-2,4-dioxopyrido[2,3-d]pyrimidin-3-yl)-N-(3-methoxyphenyl)acetamide
CID 18567398
5-benzyl-1-methyl-6-propan-2-yloxy-3-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 145017403
2-(1-methyl-2,4-dioxo-5-propoxypyrido[2,3-d]pyrimidin-3-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 16801622
6-(2-methoxyphenyl)-4,7,8-trimethyl-2-propylpurino[7,8-a]imidazole-1,3-dione
CID 16615630
6-(2,5-dimethoxyphenyl)-4,7-dimethyl-2-propylpurino[7,8-a]imidazole-1,3-dione
CID 3163018

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione (CID 18567251) is 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione is CCCn1c(=O)c2c(OC)ccnc2n(C)c1=O.
What is the InChIKey of 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is BRARZTPKNHASLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3/c1-4-7-15-11(16)9-8(18-3)5-6-13-10(9)14(2)12(15)17/h5-6H,4,7H2,1-3H3.
What are the key properties of 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione?
5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 249.27 g/mol, XLogP of 0.51, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-methyl-3-propylpyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 18567251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).