N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide

C17H16N2O2 — CID 175868815

IUPACN-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide
SMILESCCN(C(=O)c1ccccc1)c1ccc2nc(C)oc2c1
InChIInChI=1S/C17H16N2O2/c1-3-19(17(20)13-7-5-4-6-8-13)14-9-10-15-16(11-14)21-12(2)18-15/h4-11H,3H2,1-2H3
InChIKeyQANHEXKINPTQRL-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.80
Rot. Bonds3

About N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide

N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide (PubChem CID 175868815) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide.

Molecular Properties

Compound NameN-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide
PubChem CID175868815
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC NameN-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide
SMILESCCN(C(=O)c1ccccc1)c1ccc2nc(C)oc2c1
InChIInChI=1S/C17H16N2O2/c1-3-19(17(20)13-7-5-4-6-8-13)14-9-10-15-16(11-14)21-12(2)18-15/h4-11H,3H2,1-2H3
InChIKeyQANHEXKINPTQRL-UHFFFAOYSA-N
XLogP3.80
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide 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

2-bromo-N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)acetamide
CID 166505833
N-benzyl-N-ethyl-2-methyl-1,3-benzoxazole-6-carboxamide
CID 110765217
N-(3,5-dimethylphenyl)-N-ethylbenzamide
CID 52574489
2,2-dimethyl-3-[methyl-(2-methyl-1,3-benzoxazol-6-yl)amino]propanoic acid
CID 115136508
N-(3-aminophenyl)-N-ethylbenzamide
CID 63229786
[methyl-(2-methyl-1,3-benzoxazol-6-yl)amino]methanethiol
CID 115227813
4-(2-methyl-1,3-benzoxazol-6-yl)-4-oxobutanoic acid
CID 82495960
methyl 3-[methyl-(2-methyl-1,3-benzoxazol-6-yl)amino]propanoate
CID 115232332
N-benzyl-N,2-dimethyl-1,3-benzoxazole-5-carboxamide
CID 110387920
N-ethyl-5-methyl-N-phenylfuro[3,2-b]pyridine-2-carboxamide
CID 16906958
N-ethyl-3,5-dimethyl-N-phenylbenzamide
CID 134028664
2-methyl-1,3-benzoxazole-6-carboxamide
CID 82490560

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide?
The IUPAC name of N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide (CID 175868815) is N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide.
What is the SMILES notation for N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide?
The canonical SMILES for N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide is CCN(C(=O)c1ccccc1)c1ccc2nc(C)oc2c1.
What is the InChIKey of N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide?
The InChIKey is QANHEXKINPTQRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-3-19(17(20)13-7-5-4-6-8-13)14-9-10-15-16(11-14)21-12(2)18-15/h4-11H,3H2,1-2H3.
What are the key properties of N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide?
N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide has a molecular weight of 280.33 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)benzamide is sourced from PubChem (CID 175868815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).