N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide

C13H24N2O — CID 107398386

IUPACN-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide
SMILESCCN(CC1CCC1)C(=O)CC1CCCN1
InChIInChI=1S/C13H24N2O/c1-2-15(10-11-5-3-6-11)13(16)9-12-7-4-8-14-12/h11-12,14H,2-10H2,1H3
InChIKeyGZSSTRBIEZUMLY-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.78
Rot. Bonds5

About N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide

N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide (PubChem CID 107398386) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide
PubChem CID107398386
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide
SMILESCCN(CC1CCC1)C(=O)CC1CCCN1
InChIInChI=1S/C13H24N2O/c1-2-15(10-11-5-3-6-11)13(16)9-12-7-4-8-14-12/h11-12,14H,2-10H2,1H3
InChIKeyGZSSTRBIEZUMLY-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide (CID 107398386) is N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide is CCN(CC1CCC1)C(=O)CC1CCCN1.
What is the InChIKey of N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide?
The InChIKey is GZSSTRBIEZUMLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-2-15(10-11-5-3-6-11)13(16)9-12-7-4-8-14-12/h11-12,14H,2-10H2,1H3.
What are the key properties of N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide?
N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide has a molecular weight of 224.35 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 107398386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).