N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide

C19H20N2O3 — CID 4139723

IUPACN-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide
SMILESCC(C)N(Cc1ccccc1)C(=O)Cn1c(=O)oc2ccccc21
InChIInChI=1S/C19H20N2O3/c1-14(2)20(12-15-8-4-3-5-9-15)18(22)13-21-16-10-6-7-11-17(16)24-19(21)23/h3-11,14H,12-13H2,1-2H3
InChIKeyGMKTVKKTZLFCQX-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.03
Rot. Bonds5

About N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide

N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide (PubChem CID 4139723) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide
PubChem CID4139723
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide
SMILESCC(C)N(Cc1ccccc1)C(=O)Cn1c(=O)oc2ccccc21
InChIInChI=1S/C19H20N2O3/c1-14(2)20(12-15-8-4-3-5-9-15)18(22)13-21-16-10-6-7-11-17(16)24-19(21)23/h3-11,14H,12-13H2,1-2H3
InChIKeyGMKTVKKTZLFCQX-UHFFFAOYSA-N
XLogP3.03
TPSA55.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide?
The IUPAC name of N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide (CID 4139723) is N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide?
The canonical SMILES for N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide is CC(C)N(Cc1ccccc1)C(=O)Cn1c(=O)oc2ccccc21.
What is the InChIKey of N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide?
The InChIKey is GMKTVKKTZLFCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-14(2)20(12-15-8-4-3-5-9-15)18(22)13-21-16-10-6-7-11-17(16)24-19(21)23/h3-11,14H,12-13H2,1-2H3.
What are the key properties of N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide?
N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide has a molecular weight of 324.38 g/mol, XLogP of 3.03, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 4139723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).