4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide

C14H16N2O2 — CID 90537604

IUPAC4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide
SMILESCc1ccc(C(=O)NCCc2cc(C)no2)cc1
InChIInChI=1S/C14H16N2O2/c1-10-3-5-12(6-4-10)14(17)15-8-7-13-9-11(2)16-18-13/h3-6,9H,7-8H2,1-2H3,(H,15,17)
InChIKeyNNYISYNVXZPWMH-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.26
Rot. Bonds4

About 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide

4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide (PubChem CID 90537604) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide
PubChem CID90537604
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide
SMILESCc1ccc(C(=O)NCCc2cc(C)no2)cc1
InChIInChI=1S/C14H16N2O2/c1-10-3-5-12(6-4-10)14(17)15-8-7-13-9-11(2)16-18-13/h3-6,9H,7-8H2,1-2H3,(H,15,17)
InChIKeyNNYISYNVXZPWMH-UHFFFAOYSA-N
XLogP2.26
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide
CID 90537602
4-(dimethylamino)-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide
CID 90537724
2-ethyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]butanamide
CID 90537585
4-(imidazol-1-ylmethyl)-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide
CID 90537554
N-[2-(furan-2-yl)ethyl]-4-methylbenzamide
CID 5305680
4-[2-(3-methyl-1,2-oxazol-5-yl)ethylamino]-4-oxobutanoic acid
CID 175958266
4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]thiadiazole-5-carboxamide
CID 90537705
N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-thiophen-2-ylacetamide
CID 71789714
2-chloro-6-fluoro-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide
CID 90537631
N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-(3-methylphenoxy)acetamide
CID 90537660
2,3-dimethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide
CID 90537616
4-methyl-N-[2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]benzamide
CID 110323732

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide?
The IUPAC name of 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide (CID 90537604) is 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide.
What is the SMILES notation for 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide?
The canonical SMILES for 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide is Cc1ccc(C(=O)NCCc2cc(C)no2)cc1.
What is the InChIKey of 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide?
The InChIKey is NNYISYNVXZPWMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10-3-5-12(6-4-10)14(17)15-8-7-13-9-11(2)16-18-13/h3-6,9H,7-8H2,1-2H3,(H,15,17).
What are the key properties of 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide?
4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide has a molecular weight of 244.29 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzamide is sourced from PubChem (CID 90537604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).