2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide

C13H15N3O2 — CID 106368567

IUPAC2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide
SMILESCc1cnc(CNC(=O)c2c(C)cccc2N)o1
InChIInChI=1S/C13H15N3O2/c1-8-4-3-5-10(14)12(8)13(17)16-7-11-15-6-9(2)18-11/h3-6H,7,14H2,1-2H3,(H,16,17)
InChIKeyJODDXXJVHMYRMV-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.80
Rot. Bonds3

About 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide

2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide (PubChem CID 106368567) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide.

Molecular Properties

Compound Name2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide
PubChem CID106368567
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide
SMILESCc1cnc(CNC(=O)c2c(C)cccc2N)o1
InChIInChI=1S/C13H15N3O2/c1-8-4-3-5-10(14)12(8)13(17)16-7-11-15-6-9(2)18-11/h3-6H,7,14H2,1-2H3,(H,16,17)
InChIKeyJODDXXJVHMYRMV-UHFFFAOYSA-N
XLogP1.80
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-3-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide
CID 113339241
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-(2-methylphenyl)acetamide
CID 110660403
2-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide
CID 106377156
2-amino-N-(furan-2-ylmethyl)-6-methylbenzamide
CID 16782827
2-hydrazinyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide
CID 106377528
5-(aminomethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]furan-2-carboxamide
CID 103811606
2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide
CID 16782894
2-amino-N-[(4,5-dimethylthiophen-2-yl)methyl]-6-methylbenzamide
CID 65241605
2-amino-N-[[4-(hydroxymethyl)phenyl]methyl]-6-methylbenzamide
CID 107229451
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-phenylacetamide
CID 110660350
2-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide
CID 103797047
5-[(5-methyl-1,3-oxazol-2-yl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 106375912

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide?
The IUPAC name of 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide (CID 106368567) is 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide.
What is the SMILES notation for 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide?
The canonical SMILES for 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide is Cc1cnc(CNC(=O)c2c(C)cccc2N)o1.
What is the InChIKey of 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide?
The InChIKey is JODDXXJVHMYRMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-8-4-3-5-10(14)12(8)13(17)16-7-11-15-6-9(2)18-11/h3-6H,7,14H2,1-2H3,(H,16,17).
What are the key properties of 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide?
2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide has a molecular weight of 245.28 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide is sourced from PubChem (CID 106368567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).