5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide

C10H14N2O3 — CID 78956870

IUPAC5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)NCC2(C)COC2)no1
InChIInChI=1S/C10H14N2O3/c1-7-3-8(12-15-7)9(13)11-4-10(2)5-14-6-10/h3H,4-6H2,1-2H3,(H,11,13)
InChIKeyBNOVKDQDWZIYSP-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.75
Rot. Bonds3

About 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide

5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide (PubChem CID 78956870) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide
PubChem CID78956870
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)NCC2(C)COC2)no1
InChIInChI=1S/C10H14N2O3/c1-7-3-8(12-15-7)9(13)11-4-10(2)5-14-6-10/h3H,4-6H2,1-2H3,(H,11,13)
InChIKeyBNOVKDQDWZIYSP-UHFFFAOYSA-N
XLogP0.75
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide
CID 24791488
6-chloro-N-[(3-methyloxetan-3-yl)methyl]pyrazine-2-carboxamide
CID 106551343
N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-5-carboxamide
CID 115825220
5-bromo-N-[(3-methyloxetan-3-yl)methyl]pyridine-2-carboxamide
CID 78957062
N-[[3,4-dihydroxy-1-(methoxymethyl)cyclopentyl]methyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 162921091
N-(2-amino-2-oxoethyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 60668189
N-[2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]ethyl]carbamate
CID 21297353
N-[(2R)-2-hydroxypropyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 83030687
5-methyl-N-[[4-(piperidin-1-ylmethyl)oxan-4-yl]methyl]-1,2-oxazole-3-carboxamide
CID 91957981
5-methyl-N-(3-methyl-2-oxobutyl)-1,2-oxazole-3-carboxamide
CID 59224444
N-(2-chloroprop-2-enyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 115636549
N-[(3-methyloxetan-3-yl)methyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 78956758

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide (CID 78956870) is 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)NCC2(C)COC2)no1.
What is the InChIKey of 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide?
The InChIKey is BNOVKDQDWZIYSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-7-3-8(12-15-7)9(13)11-4-10(2)5-14-6-10/h3H,4-6H2,1-2H3,(H,11,13).
What are the key properties of 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide?
5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide has a molecular weight of 210.23 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 78956870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).