N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide

C11H17N3O3 — CID 81178209

IUPACN-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide
SMILESO=C(CNCc1ccon1)NC1CCOCC1
InChIInChI=1S/C11H17N3O3/c15-11(13-9-1-4-16-5-2-9)8-12-7-10-3-6-17-14-10/h3,6,9,12H,1-2,4-5,7-8H2,(H,13,15)
InChIKeyPAWZKDMTRSUVEJ-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.06
Rot. Bonds5

About N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide

N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide (PubChem CID 81178209) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide
PubChem CID81178209
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC NameN-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide
SMILESO=C(CNCc1ccon1)NC1CCOCC1
InChIInChI=1S/C11H17N3O3/c15-11(13-9-1-4-16-5-2-9)8-12-7-10-3-6-17-14-10/h3,6,9,12H,1-2,4-5,7-8H2,(H,13,15)
InChIKeyPAWZKDMTRSUVEJ-UHFFFAOYSA-N
XLogP0.06
TPSA76.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide 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

N-cycloheptyl-2-(1,2-oxazol-3-ylmethylamino)acetamide
CID 81177432
N-(oxan-4-yl)-4-(1,2-oxazol-3-ylmethylamino)benzamide
CID 71973649
2-[(4-bromophenyl)methylamino]-N-(oxan-4-yl)acetamide
CID 63099192
2-[(4-chlorophenyl)methylamino]-N-(oxan-4-yl)acetamide
CID 63099718
2-[(5-ethylthiophen-2-yl)methylamino]-N-(oxan-4-yl)acetamide
CID 106010838
2-[(6-methoxy-3-pyridinyl)methylamino]-N-(oxan-4-yl)acetamide
CID 63097814
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-N-(oxan-4-yl)acetamide
CID 79241619
2-[(3-fluorophenyl)methylamino]-N-(oxan-4-yl)acetamide
CID 63100231
N-(oxan-4-yl)-2-(oxan-4-ylmethylamino)acetamide
CID 63712370
2-[(2-nitrophenyl)methylamino]-N-(oxan-4-yl)acetamide
CID 63099902
N-(2,2-dimethyloxan-4-yl)-2-(1,2-oxazol-3-yl)acetamide
CID 136517618
N-cyclopropyl-2-(quinolin-2-ylmethylamino)acetamide
CID 43401916

Frequently Asked Questions

What is the IUPAC name of N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide?
The IUPAC name of N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide (CID 81178209) is N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide.
What is the SMILES notation for N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide?
The canonical SMILES for N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide is O=C(CNCc1ccon1)NC1CCOCC1.
What is the InChIKey of N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide?
The InChIKey is PAWZKDMTRSUVEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c15-11(13-9-1-4-16-5-2-9)8-12-7-10-3-6-17-14-10/h3,6,9,12H,1-2,4-5,7-8H2,(H,13,15).
What are the key properties of N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide?
N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide has a molecular weight of 239.27 g/mol, XLogP of 0.06, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-4-yl)-2-(1,2-oxazol-3-ylmethylamino)acetamide is sourced from PubChem (CID 81178209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).