N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide

C15H24N4O3 — CID 46982324

IUPACN-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide
SMILESCc1cc(C)n(CCNC(=O)CCN2CCCCO2)c(=O)n1
InChIInChI=1S/C15H24N4O3/c1-12-11-13(2)19(15(21)17-12)9-6-16-14(20)5-8-18-7-3-4-10-22-18/h11H,3-10H2,1-2H3,(H,16,20)
InChIKeyATKJHSUSHWCDBM-UHFFFAOYSA-N
MW308.38 g/mol
LogP0.39
Rot. Bonds6

About N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide

N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide (PubChem CID 46982324) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide.

Molecular Properties

Compound NameN-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide
PubChem CID46982324
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC NameN-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide
SMILESCc1cc(C)n(CCNC(=O)CCN2CCCCO2)c(=O)n1
InChIInChI=1S/C15H24N4O3/c1-12-11-13(2)19(15(21)17-12)9-6-16-14(20)5-8-18-7-3-4-10-22-18/h11H,3-10H2,1-2H3,(H,16,20)
InChIKeyATKJHSUSHWCDBM-UHFFFAOYSA-N
XLogP0.39
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide?
The IUPAC name of N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide (CID 46982324) is N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide.
What is the SMILES notation for N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide?
The canonical SMILES for N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide is Cc1cc(C)n(CCNC(=O)CCN2CCCCO2)c(=O)n1.
What is the InChIKey of N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide?
The InChIKey is ATKJHSUSHWCDBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-12-11-13(2)19(15(21)17-12)9-6-16-14(20)5-8-18-7-3-4-10-22-18/h11H,3-10H2,1-2H3,(H,16,20).
What are the key properties of N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide?
N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide has a molecular weight of 308.38 g/mol, XLogP of 0.39, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-(oxazinan-2-yl)propanamide is sourced from PubChem (CID 46982324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).