1-(dimethylamino)-5-methylpyrimidine-2,4-dione

C7H11N3O2 — CID 54265246

IUPAC1-(dimethylamino)-5-methylpyrimidine-2,4-dione
SMILESCc1cn(N(C)C)c(=O)[nH]c1=O
InChIInChI=1S/C7H11N3O2/c1-5-4-10(9(2)3)7(12)8-6(5)11/h4H,1-3H3,(H,8,11,12)
InChIKeyRGHJFZXDJIXMQK-UHFFFAOYSA-N
MW169.18 g/mol
LogP-0.96
Rot. Bonds1

About 1-(dimethylamino)-5-methylpyrimidine-2,4-dione

1-(dimethylamino)-5-methylpyrimidine-2,4-dione (PubChem CID 54265246) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is 1-(dimethylamino)-5-methylpyrimidine-2,4-dione.

Molecular Properties

Compound Name1-(dimethylamino)-5-methylpyrimidine-2,4-dione
PubChem CID54265246
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC Name1-(dimethylamino)-5-methylpyrimidine-2,4-dione
SMILESCc1cn(N(C)C)c(=O)[nH]c1=O
InChIInChI=1S/C7H11N3O2/c1-5-4-10(9(2)3)7(12)8-6(5)11/h4H,1-3H3,(H,8,11,12)
InChIKeyRGHJFZXDJIXMQK-UHFFFAOYSA-N
XLogP-0.96
TPSA58.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 5-0.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(dimethylamino)-5-methylpyrimidine-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

Thymine
CID 1135
1,5-Dimethyl-2,4(1H,3H)-pyrimidinedione
CID 95961
5-Ethyl-2,4(1H,3H)-pyrimidinedione
CID 73267
3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione
CID 123209
N,N-Dimethylthymine
CID 78112
2,4(1H,3H)-Pyrimidinedione, 5-methyl-1-(2-propynyl)-
CID 489882
5-[(dimethylamino)methyl]-1H-pyrimidine-2,4-dione
CID 408478
1-Vinylthymine
CID 4652520
1-Ethylthymine
CID 5246756
2,4(1H,3H)-Pyrimidinedione, 5-methyl-, dimer
CID 160169
Fluorothymine
CID 101251837
3-acetyl-5-methylpyrimidine-2,4(1H,3H)-dione
CID 580962

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-5-methylpyrimidine-2,4-dione?
The IUPAC name of 1-(dimethylamino)-5-methylpyrimidine-2,4-dione (CID 54265246) is 1-(dimethylamino)-5-methylpyrimidine-2,4-dione.
What is the SMILES notation for 1-(dimethylamino)-5-methylpyrimidine-2,4-dione?
The canonical SMILES for 1-(dimethylamino)-5-methylpyrimidine-2,4-dione is Cc1cn(N(C)C)c(=O)[nH]c1=O.
What is the InChIKey of 1-(dimethylamino)-5-methylpyrimidine-2,4-dione?
The InChIKey is RGHJFZXDJIXMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c1-5-4-10(9(2)3)7(12)8-6(5)11/h4H,1-3H3,(H,8,11,12).
What are the key properties of 1-(dimethylamino)-5-methylpyrimidine-2,4-dione?
1-(dimethylamino)-5-methylpyrimidine-2,4-dione has a molecular weight of 169.18 g/mol, XLogP of -0.96, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)-5-methylpyrimidine-2,4-dione is sourced from PubChem (CID 54265246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).