N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide

C15H20N4O4 — CID 90652303

IUPACN-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
SMILESCc1noc(C)c1CCCNC(=O)Cn1cc(C)c(=O)[nH]c1=O
InChIInChI=1S/C15H20N4O4/c1-9-7-19(15(22)17-14(9)21)8-13(20)16-6-4-5-12-10(2)18-23-11(12)3/h7H,4-6,8H2,1-3H3,(H,16,20)(H,17,21,22)
InChIKeyNMPXLGUOAQHXQV-UHFFFAOYSA-N
MW320.35 g/mol
LogP0.20
Rot. Bonds6

About N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide

N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide (PubChem CID 90652303) has the molecular formula C15H20N4O4 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
PubChem CID90652303
Molecular FormulaC15H20N4O4
Molecular Weight320.35 g/mol
Exact Mass320.15
IUPAC NameN-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
SMILESCc1noc(C)c1CCCNC(=O)Cn1cc(C)c(=O)[nH]c1=O
InChIInChI=1S/C15H20N4O4/c1-9-7-19(15(22)17-14(9)21)8-13(20)16-6-4-5-12-10(2)18-23-11(12)3/h7H,4-6,8H2,1-3H3,(H,16,20)(H,17,21,22)
InChIKeyNMPXLGUOAQHXQV-UHFFFAOYSA-N
XLogP0.20
TPSA109.99 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide 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

3-(5-methyl-2,4-dioxopyrimidin-1-yl)-N-pentylpropanamide
CID 11277154
methyl 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetate
CID 3757668
N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-3-methylsulfonylpropanamide
CID 131925760
N-[2-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]ethyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
CID 99930693
N-(3-diethoxyphosphoryl-3-hydroxypropyl)-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
CID 137346213
5-methyl-1-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]pyrimidine-2,4-dione
CID 60734768
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-(3,6,7-trimethyl-2-oxoquinoxalin-1-yl)acetamide
CID 46295540
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-[5-(4-fluorophenyl)tetrazol-2-yl]acetamide
CID 856763
2-(5-methyl-2,4-dioxopyrimidin-1-yl)-N-(2-methylphenyl)acetamide
CID 35177235
N-[1-[2-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethylamino]-2-oxoethyl]triazol-4-yl]propanamide
CID 112529878
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[3-(1H-1,2,4-triazol-5-yl)propyl]acetamide
CID 64547519
5-methyl-1-[2-(4-methylphenyl)-2-oxoethyl]pyrimidine-2,4-dione
CID 60734699

Frequently Asked Questions

What is the IUPAC name of N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The IUPAC name of N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide (CID 90652303) is N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide is Cc1noc(C)c1CCCNC(=O)Cn1cc(C)c(=O)[nH]c1=O.
What is the InChIKey of N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The InChIKey is NMPXLGUOAQHXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O4/c1-9-7-19(15(22)17-14(9)21)8-13(20)16-6-4-5-12-10(2)18-23-11(12)3/h7H,4-6,8H2,1-3H3,(H,16,20)(H,17,21,22).
What are the key properties of N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide has a molecular weight of 320.35 g/mol, XLogP of 0.20, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 90652303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).