2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide

C14H17N3O3 — CID 43447858

IUPAC2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide
SMILESNc1ccc2oc(=O)n(CC(=O)NC3CCCC3)c2c1
InChIInChI=1S/C14H17N3O3/c15-9-5-6-12-11(7-9)17(14(19)20-12)8-13(18)16-10-3-1-2-4-10/h5-7,10H,1-4,8,15H2,(H,16,18)
InChIKeyARCPEGWYESABCP-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.24
Rot. Bonds3

About 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide

2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide (PubChem CID 43447858) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide
PubChem CID43447858
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide
SMILESNc1ccc2oc(=O)n(CC(=O)NC3CCCC3)c2c1
InChIInChI=1S/C14H17N3O3/c15-9-5-6-12-11(7-9)17(14(19)20-12)8-13(18)16-10-3-1-2-4-10/h5-7,10H,1-4,8,15H2,(H,16,18)
InChIKeyARCPEGWYESABCP-UHFFFAOYSA-N
XLogP1.24
TPSA90.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopentyl-2-[2-oxo-5-(pyrrolidine-1-carbonyl)-1,3-benzoxazol-3-yl]acetamide
CID 53006890
N-cyclooctyl-2-(2-oxo-6-sulfamoyl-1,3-benzoxazol-3-yl)acetamide
CID 36995103
2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-(2-methylpropyl)acetamide
CID 43447893
2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopropylacetamide
CID 8986163
2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-(2-methoxyethyl)acetamide
CID 61487292
2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopropyl-N-ethylacetamide
CID 61488264
2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N,N-diethylacetamide
CID 43447892
ethyl 4-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]piperidine-1-carboxylate
CID 23794461
3-[2-(cyclopropylamino)-2-oxoethyl]-N-(4-methylphenyl)-2-oxo-1,3-benzoxazole-5-carboxamide
CID 50842111
N-cycloheptyl-2-(2-oxo-6-piperidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)acetamide
CID 20879513
N-[(1S,2S)-2-hydroxycyclohexyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 104957458
N-[(1R,2R)-2-hydroxycyclohexyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 104927452

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide?
The IUPAC name of 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide (CID 43447858) is 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide is Nc1ccc2oc(=O)n(CC(=O)NC3CCCC3)c2c1.
What is the InChIKey of 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide?
The InChIKey is ARCPEGWYESABCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c15-9-5-6-12-11(7-9)17(14(19)20-12)8-13(18)16-10-3-1-2-4-10/h5-7,10H,1-4,8,15H2,(H,16,18).
What are the key properties of 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide?
2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide has a molecular weight of 275.31 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1,3-benzoxazol-3-yl)-N-cyclopentylacetamide is sourced from PubChem (CID 43447858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).