5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione

C11H18N2O2 — CID 59743975

IUPAC5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione
SMILESCn1cc(CC(C)(C)C)c(=O)n(C)c1=O
InChIInChI=1S/C11H18N2O2/c1-11(2,3)6-8-7-12(4)10(15)13(5)9(8)14/h7H,6H2,1-5H3
InChIKeySBAMAFRCWAMOTC-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.67
Rot. Bonds1

About 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione

5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione (PubChem CID 59743975) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione
PubChem CID59743975
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione
SMILESCn1cc(CC(C)(C)C)c(=O)n(C)c1=O
InChIInChI=1S/C11H18N2O2/c1-11(2,3)6-8-7-12(4)10(15)13(5)9(8)14/h7H,6H2,1-5H3
InChIKeySBAMAFRCWAMOTC-UHFFFAOYSA-N
XLogP0.67
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-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

1,3-Dimethyl-5-ethyluracil
CID 141656
Uracil, 1-allyl-3-ethyl-5-propyl-
CID 210803
Uracil, 1-allyl-3-methyl-5-propyl-
CID 212854
5-Butyl-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
CID 13897053
1,3-Dimethyl-5-isopropyluracil
CID 53658421
5-(2-Methylpropyl)pyrimidine-2,4(1h,3h)-dione
CID 289071
1,3-Dimethyl-5-propylpyrimidine-2,4(1H,3H)-dione
CID 71418704
1,3-Dimethyl-5-(2-methylprop-2-enyl)pyrimidine-2,4-dione
CID 101809747
3-(1,3-Dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidin-5-yl)-propionamide
CID 4646503
5-Cyclopropyl-1-propylpyrimidine-2,4-dione
CID 10465221
3-(1,3-Dimethyl-2,4-dioxopyrimidin-5-yl)-2,2-dimethylbutanenitrile
CID 12586367
5-(2-methyl-prop-2-enyl)-1H-pyrimidine-2,4-dione
CID 24972392

Frequently Asked Questions

What is the IUPAC name of 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione?
The IUPAC name of 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione (CID 59743975) is 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione is Cn1cc(CC(C)(C)C)c(=O)n(C)c1=O.
What is the InChIKey of 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione?
The InChIKey is SBAMAFRCWAMOTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-11(2,3)6-8-7-12(4)10(15)13(5)9(8)14/h7H,6H2,1-5H3.
What are the key properties of 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione?
5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione has a molecular weight of 210.28 g/mol, XLogP of 0.67, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2-dimethylpropyl)-1,3-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 59743975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).