2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide

C19H20N2O3 — CID 46401841

IUPAC2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc2oc(C(C)C)nc2c1
InChIInChI=1S/C19H20N2O3/c1-4-23-16-8-6-5-7-14(16)18(22)20-13-9-10-17-15(11-13)21-19(24-17)12(2)3/h5-12H,4H2,1-3H3,(H,20,22)
InChIKeyRRFKRDGQVWLEBM-UHFFFAOYSA-N
MW324.38 g/mol
LogP4.60
Rot. Bonds5

About 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide

2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide (PubChem CID 46401841) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide.

Molecular Properties

Compound Name2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
PubChem CID46401841
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc2oc(C(C)C)nc2c1
InChIInChI=1S/C19H20N2O3/c1-4-23-16-8-6-5-7-14(16)18(22)20-13-9-10-17-15(11-13)21-19(24-17)12(2)3/h5-12H,4H2,1-3H3,(H,20,22)
InChIKeyRRFKRDGQVWLEBM-UHFFFAOYSA-N
XLogP4.60
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]benzamide
CID 86768124
2-methoxy-N-[3-oxo-3-[(2-propan-2-yl-1,3-benzoxazol-5-yl)amino]propyl]benzamide
CID 46401809
N-dibenzofuran-2-yl-2-ethoxybenzamide
CID 16552367
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
2-methyl-N-[2-oxo-2-[(2-propan-2-yl-1,3-benzoxazol-5-yl)amino]ethyl]benzamide
CID 46416362
(2S,3S)-2-amino-3-methyl-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)pentanamide
CID 61179344
2-ethoxy-N-[2-(4-methylphenyl)-1,3-benzoxazol-6-yl]benzamide
CID 9320899
5-(2-methoxyphenyl)-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)-1,2-oxazole-3-carboxamide
CID 47028094
2-amino-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)butanamide
CID 43711177
2-methoxy-N-[2-(4-propan-2-ylphenyl)-1,3-benzoxazol-5-yl]benzamide
CID 17127516
3-acetamido-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
CID 46401870
3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
CID 46424516

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide?
The IUPAC name of 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide (CID 46401841) is 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide.
What is the SMILES notation for 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide?
The canonical SMILES for 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide is CCOc1ccccc1C(=O)Nc1ccc2oc(C(C)C)nc2c1.
What is the InChIKey of 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide?
The InChIKey is RRFKRDGQVWLEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-4-23-16-8-6-5-7-14(16)18(22)20-13-9-10-17-15(11-13)21-19(24-17)12(2)3/h5-12H,4H2,1-3H3,(H,20,22).
What are the key properties of 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide?
2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide has a molecular weight of 324.38 g/mol, XLogP of 4.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide is sourced from PubChem (CID 46401841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).