2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide

C16H25N3O2 — CID 86791131

IUPAC2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide
SMILESCc1noc(C)c1C(C)NC(=O)C(C1CC1)N1CCCC1
InChIInChI=1S/C16H25N3O2/c1-10(14-11(2)18-21-12(14)3)17-16(20)15(13-6-7-13)19-8-4-5-9-19/h10,13,15H,4-9H2,1-3H3,(H,17,20)
InChIKeyOCUQWUAWRXKUQW-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.34
Rot. Bonds5

About 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide

2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide (PubChem CID 86791131) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide
PubChem CID86791131
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide
SMILESCc1noc(C)c1C(C)NC(=O)C(C1CC1)N1CCCC1
InChIInChI=1S/C16H25N3O2/c1-10(14-11(2)18-21-12(14)3)17-16(20)15(13-6-7-13)19-8-4-5-9-19/h10,13,15H,4-9H2,1-3H3,(H,17,20)
InChIKeyOCUQWUAWRXKUQW-UHFFFAOYSA-N
XLogP2.34
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide?
The IUPAC name of 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide (CID 86791131) is 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide is Cc1noc(C)c1C(C)NC(=O)C(C1CC1)N1CCCC1.
What is the InChIKey of 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide?
The InChIKey is OCUQWUAWRXKUQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-10(14-11(2)18-21-12(14)3)17-16(20)15(13-6-7-13)19-8-4-5-9-19/h10,13,15H,4-9H2,1-3H3,(H,17,20).
What are the key properties of 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide?
2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide has a molecular weight of 291.39 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 86791131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).