5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione

C11H12N4O2 — CID 55240714

IUPAC5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione
SMILESCn1cc(N)c(=O)n(Cc2ccccn2)c1=O
InChIInChI=1S/C11H12N4O2/c1-14-7-9(12)10(16)15(11(14)17)6-8-4-2-3-5-13-8/h2-5,7H,6,12H2,1H3
InChIKeyIWZONYMXPOYZDC-UHFFFAOYSA-N
MW232.24 g/mol
LogP-0.43
Rot. Bonds2

About 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione

5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione (PubChem CID 55240714) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione
PubChem CID55240714
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione
SMILESCn1cc(N)c(=O)n(Cc2ccccn2)c1=O
InChIInChI=1S/C11H12N4O2/c1-14-7-9(12)10(16)15(11(14)17)6-8-4-2-3-5-13-8/h2-5,7H,6,12H2,1H3
InChIKeyIWZONYMXPOYZDC-UHFFFAOYSA-N
XLogP-0.43
TPSA82.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-1-methyl-3-[(3-methyl-2-pyridinyl)methyl]pyrimidine-2,4-dione
CID 112650322
5-amino-1-methyl-3-[(1-methyltriazol-4-yl)methyl]pyrimidine-2,4-dione
CID 107042848
3-(aminomethyl)-6-methyl-1-(pyridin-2-ylmethyl)pyridin-2-one
CID 107073142
5-[(5-amino-3-methyl-2,6-dioxopyrimidin-1-yl)methyl]-2-fluorobenzonitrile
CID 107880877
5-amino-3-[(2-chloro-5-fluorophenyl)methyl]-1-methylpyrimidine-2,4-dione
CID 102616051
3-(2-methylphenyl)-1-(pyridin-2-ylmethyl)-7H-purine-2,6-dione
CID 175928852
5-amino-1-(2-pyridin-2-ylethyl)pyrimidine-2,4-dione
CID 63801481
methyl 2-[3-methyl-2,6-dioxo-1-(pyridin-2-ylmethyl)purin-7-yl]propanoate
CID 118961132
1-[4-(methylamino)butyl]-3-(pyridin-2-ylmethyl)benzimidazol-2-one
CID 21273540
1,3-dimethyl-2,4-dioxo-N-(pyridin-2-ylmethyl)pyrimidine-5-carboxamide
CID 84557714
5-amino-3-bromo-1-(2-pyridin-2-ylethyl)pyridin-2-one
CID 80501795
5-amino-6-fluoro-3-(pyridin-2-ylmethyl)-1,3-benzothiazol-2-one
CID 15622567

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione?
The IUPAC name of 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione (CID 55240714) is 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione.
What is the SMILES notation for 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione?
The canonical SMILES for 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione is Cn1cc(N)c(=O)n(Cc2ccccn2)c1=O.
What is the InChIKey of 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione?
The InChIKey is IWZONYMXPOYZDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-14-7-9(12)10(16)15(11(14)17)6-8-4-2-3-5-13-8/h2-5,7H,6,12H2,1H3.
What are the key properties of 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione?
5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione has a molecular weight of 232.24 g/mol, XLogP of -0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methyl-3-(pyridin-2-ylmethyl)pyrimidine-2,4-dione is sourced from PubChem (CID 55240714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).