2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole

C16H20N4O4 — CID 159975295

IUPAC2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole
SMILESCc1ccno1.Cc1cnco1.Cc1cocn1.Cc1ncco1
InChIInChI=1S/4C4H5NO/c1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-3-5-6-4/h4*2-3H,1H3
InChIKeyOFBPEFWXACVCGI-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.93
Rot. Bonds

About 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole

2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole (PubChem CID 159975295) has the molecular formula C16H20N4O4 and a molecular weight of 332.36 g/mol. Its IUPAC name is 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole.

Molecular Properties

Compound Name2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole
PubChem CID159975295
Molecular FormulaC16H20N4O4
Molecular Weight332.36 g/mol
Exact Mass332.15
IUPAC Name2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole
SMILESCc1ccno1.Cc1cnco1.Cc1cocn1.Cc1ncco1
InChIInChI=1S/4C4H5NO/c1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-3-5-6-4/h4*2-3H,1H3
InChIKeyOFBPEFWXACVCGI-UHFFFAOYSA-N
XLogP3.93
TPSA104.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole 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

Ethane;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole
CID 155692309
2-Methyl-1,3-oxazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole
CID 157448271
Ethane;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole
CID 159663872
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-[1-(1,2-oxazol-5-ylmethyl)pyrrolidin-3-yl]acetamide
CID 71872508
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-[(3R)-1-(1,2-oxazol-5-ylmethyl)pyrrolidin-3-yl]acetamide
CID 96512270
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-[(3S)-1-(1,2-oxazol-5-ylmethyl)pyrrolidin-3-yl]acetamide
CID 96512271

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole?
The IUPAC name of 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole (CID 159975295) is 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole.
What is the SMILES notation for 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole?
The canonical SMILES for 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole is Cc1ccno1.Cc1cnco1.Cc1cocn1.Cc1ncco1.
What is the InChIKey of 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole?
The InChIKey is OFBPEFWXACVCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/4C4H5NO/c1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-3-5-6-4/h4*2-3H,1H3.
What are the key properties of 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole?
2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole has a molecular weight of 332.36 g/mol, XLogP of 3.93, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole is sourced from PubChem (CID 159975295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).