6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione

C11H11N3O4 — CID 170923877

IUPAC6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione
SMILESCOc1ccc(Cn2c(O)cc(=O)[nH]c2=O)cn1
InChIInChI=1S/C11H11N3O4/c1-18-9-3-2-7(5-12-9)6-14-10(16)4-8(15)13-11(14)17/h2-5,16H,6H2,1H3,(H,13,15,17)
InChIKeyCXUGACPNEWQKHC-UHFFFAOYSA-N
MW249.23 g/mol
LogP-0.31
Rot. Bonds3

About 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione

6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione (PubChem CID 170923877) has the molecular formula C11H11N3O4 and a molecular weight of 249.23 g/mol. Its IUPAC name is 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione
PubChem CID170923877
Molecular FormulaC11H11N3O4
Molecular Weight249.23 g/mol
Exact Mass249.07
IUPAC Name6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione
SMILESCOc1ccc(Cn2c(O)cc(=O)[nH]c2=O)cn1
InChIInChI=1S/C11H11N3O4/c1-18-9-3-2-7(5-12-9)6-14-10(16)4-8(15)13-11(14)17/h2-5,16H,6H2,1H3,(H,13,15,17)
InChIKeyCXUGACPNEWQKHC-UHFFFAOYSA-N
XLogP-0.31
TPSA97.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.23
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(6-methoxy-3-pyridinyl)methyl]piperazine-2,6-dione
CID 55237904
6-hydroxy-1-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrimidine-2,4-dione
CID 106377411
6-bromo-3-[(6-methoxy-3-pyridinyl)methyl]-1H-imidazo[4,5-b]pyridine-2-thione
CID 79306401
1-[(6-methoxy-3-pyridinyl)methyl]pyrrolidine-2,3-dione
CID 62992277
5-chloro-3-[(6-methoxy-3-pyridinyl)methyl]-1H-benzimidazole-2-thione
CID 115470091
4-[(6-methoxy-3-pyridinyl)methylamino]-2-methyl-1H-pyrimidin-6-one
CID 136975577
3-bromo-1-[(6-methoxy-3-pyridinyl)methyl]pyrrolidin-2-one
CID 63789999
1-(6-methoxy-3-pyridinyl)propan-2-one
CID 19760371
2-[[4-[(6-methoxy-3-pyridinyl)methyl]-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid
CID 62991956
3-[(6-methoxy-3-pyridinyl)methyl]-4-methyl-1H-benzimidazole-2-thione
CID 115551903
1-[(6-methoxy-3-pyridinyl)methyl]-3,6-dimethylpiperazine-2,5-dione
CID 64969942
3-[(6-methoxy-3-pyridinyl)methyl]-5-methyl-1H-imidazole-2-thione
CID 81335625

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione?
The IUPAC name of 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione (CID 170923877) is 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione.
What is the SMILES notation for 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione?
The canonical SMILES for 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione is COc1ccc(Cn2c(O)cc(=O)[nH]c2=O)cn1.
What is the InChIKey of 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione?
The InChIKey is CXUGACPNEWQKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O4/c1-18-9-3-2-7(5-12-9)6-14-10(16)4-8(15)13-11(14)17/h2-5,16H,6H2,1H3,(H,13,15,17).
What are the key properties of 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione?
6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione has a molecular weight of 249.23 g/mol, XLogP of -0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-1-[(6-methoxy-3-pyridinyl)methyl]pyrimidine-2,4-dione is sourced from PubChem (CID 170923877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).