5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione

C14H18N4O2 — CID 63800812

IUPAC5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione
SMILESCCCn1cc(N)c(=O)n(CCc2cccnc2)c1=O
InChIInChI=1S/C14H18N4O2/c1-2-7-17-10-12(15)13(19)18(14(17)20)8-5-11-4-3-6-16-9-11/h3-4,6,9-10H,2,5,7-8,15H2,1H3
InChIKeyONCJBRJWIYZMBG-UHFFFAOYSA-N
MW274.32 g/mol
LogP0.64
Rot. Bonds5

About 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione

5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione (PubChem CID 63800812) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione
PubChem CID63800812
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione
SMILESCCCn1cc(N)c(=O)n(CCc2cccnc2)c1=O
InChIInChI=1S/C14H18N4O2/c1-2-7-17-10-12(15)13(19)18(14(17)20)8-5-11-4-3-6-16-9-11/h3-4,6,9-10H,2,5,7-8,15H2,1H3
InChIKeyONCJBRJWIYZMBG-UHFFFAOYSA-N
XLogP0.64
TPSA82.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)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

5-amino-1-propyl-3-(2-pyridin-4-ylethyl)pyrimidine-2,4-dione
CID 63799243
5-amino-1-propyl-3-(2-propylsulfonylethyl)pyrimidine-2,4-dione
CID 106724722
1-propyl-4-(2-pyridin-3-ylethyl)piperazine
CID 171561190
5-amino-3-(cyclopropylmethyl)-1-propylpyrimidine-2,4-dione
CID 63800468
ethyl 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)acetate
CID 55240716
5-amino-1-ethyl-3-(2-pyrazol-1-ylethyl)pyrimidine-2,4-dione
CID 63799585
5-iodo-3-(2-pyridin-3-ylethyl)pyrimidin-4-one
CID 66310563
1-propyl-3-(pyridin-3-ylmethylamino)pyrazin-2-one
CID 55155833
1-(1-propylpyrazol-4-yl)-3-pyridin-3-ylpropan-1-one
CID 105082099
5-amino-1-methyl-3-[2-(1-methylpyrazol-4-yl)ethyl]pyrimidine-2,4-dione
CID 103002422
5-methyl-3-(2-pyridin-3-ylethyl)-1H-imidazole-2-thione
CID 81334784
1-propyl-3-(2-pyridin-4-ylethyl)pyrimidine-2,4-dione
CID 63811395

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione?
The IUPAC name of 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione (CID 63800812) is 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione.
What is the SMILES notation for 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione?
The canonical SMILES for 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione is CCCn1cc(N)c(=O)n(CCc2cccnc2)c1=O.
What is the InChIKey of 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione?
The InChIKey is ONCJBRJWIYZMBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-2-7-17-10-12(15)13(19)18(14(17)20)8-5-11-4-3-6-16-9-11/h3-4,6,9-10H,2,5,7-8,15H2,1H3.
What are the key properties of 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione?
5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione has a molecular weight of 274.32 g/mol, XLogP of 0.64, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-propyl-3-(2-pyridin-3-ylethyl)pyrimidine-2,4-dione is sourced from PubChem (CID 63800812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).