N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide

C13H21N3O2 — CID 71873201

IUPACN-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide
SMILESCC(=O)N(Cc1ncc(C(C)C)o1)C1CCNC1
InChIInChI=1S/C13H21N3O2/c1-9(2)12-7-15-13(18-12)8-16(10(3)17)11-4-5-14-6-11/h7,9,11,14H,4-6,8H2,1-3H3
InChIKeyBBPCZOMOPFDMKH-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.51
Rot. Bonds4

About N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide

N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide (PubChem CID 71873201) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide.

Molecular Properties

Compound NameN-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide
PubChem CID71873201
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC NameN-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide
SMILESCC(=O)N(Cc1ncc(C(C)C)o1)C1CCNC1
InChIInChI=1S/C13H21N3O2/c1-9(2)12-7-15-13(18-12)8-16(10(3)17)11-4-5-14-6-11/h7,9,11,14H,4-6,8H2,1-3H3
InChIKeyBBPCZOMOPFDMKH-UHFFFAOYSA-N
XLogP1.51
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide?
The IUPAC name of N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide (CID 71873201) is N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide.
What is the SMILES notation for N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide?
The canonical SMILES for N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide is CC(=O)N(Cc1ncc(C(C)C)o1)C1CCNC1.
What is the InChIKey of N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide?
The InChIKey is BBPCZOMOPFDMKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-9(2)12-7-15-13(18-12)8-16(10(3)17)11-4-5-14-6-11/h7,9,11,14H,4-6,8H2,1-3H3.
What are the key properties of N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide?
N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide has a molecular weight of 251.33 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 71873201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).