N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide

C10H17N3O2 — CID 65487201

IUPACN-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide
SMILESCCNCCC(=O)Nc1onc(C)c1C
InChIInChI=1S/C10H17N3O2/c1-4-11-6-5-9(14)12-10-7(2)8(3)13-15-10/h11H,4-6H2,1-3H3,(H,12,14)
InChIKeyYRURVHPIRDKGNV-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.23
Rot. Bonds5

About N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide

N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide (PubChem CID 65487201) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide.

Molecular Properties

Compound NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide
PubChem CID65487201
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC NameN-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide
SMILESCCNCCC(=O)Nc1onc(C)c1C
InChIInChI=1S/C10H17N3O2/c1-4-11-6-5-9(14)12-10-7(2)8(3)13-15-10/h11H,4-6H2,1-3H3,(H,12,14)
InChIKeyYRURVHPIRDKGNV-UHFFFAOYSA-N
XLogP1.23
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide?
The IUPAC name of N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide (CID 65487201) is N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide.
What is the SMILES notation for N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide?
The canonical SMILES for N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide is CCNCCC(=O)Nc1onc(C)c1C.
What is the InChIKey of N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide?
The InChIKey is YRURVHPIRDKGNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-4-11-6-5-9(14)12-10-7(2)8(3)13-15-10/h11H,4-6H2,1-3H3,(H,12,14).
What are the key properties of N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide?
N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide has a molecular weight of 211.26 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethyl-1,2-oxazol-5-yl)-3-(ethylamino)propanamide is sourced from PubChem (CID 65487201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).