N-(2-pyrrolidin-1-ylethyl)acetamide

C8H16N2O — CID 21282553

IUPACN-(2-pyrrolidin-1-ylethyl)acetamide
SMILESCC(=O)NCCN1CCCC1
InChIInChI=1S/C8H16N2O/c1-8(11)9-4-7-10-5-2-3-6-10/h2-7H2,1H3,(H,9,11)
InChIKeyTYSAXPAUNHTCBB-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.22
Rot. Bonds3

About N-(2-pyrrolidin-1-ylethyl)acetamide

N-(2-pyrrolidin-1-ylethyl)acetamide (PubChem CID 21282553) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-(2-pyrrolidin-1-ylethyl)acetamide.

Molecular Properties

Compound NameN-(2-pyrrolidin-1-ylethyl)acetamide
PubChem CID21282553
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-(2-pyrrolidin-1-ylethyl)acetamide
SMILESCC(=O)NCCN1CCCC1
InChIInChI=1S/C8H16N2O/c1-8(11)9-4-7-10-5-2-3-6-10/h2-7H2,1H3,(H,9,11)
InChIKeyTYSAXPAUNHTCBB-UHFFFAOYSA-N
XLogP0.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-1-ylethyl)acetamide?
The IUPAC name of N-(2-pyrrolidin-1-ylethyl)acetamide (CID 21282553) is N-(2-pyrrolidin-1-ylethyl)acetamide.
What is the SMILES notation for N-(2-pyrrolidin-1-ylethyl)acetamide?
The canonical SMILES for N-(2-pyrrolidin-1-ylethyl)acetamide is CC(=O)NCCN1CCCC1.
What is the InChIKey of N-(2-pyrrolidin-1-ylethyl)acetamide?
The InChIKey is TYSAXPAUNHTCBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-8(11)9-4-7-10-5-2-3-6-10/h2-7H2,1H3,(H,9,11).
What are the key properties of N-(2-pyrrolidin-1-ylethyl)acetamide?
N-(2-pyrrolidin-1-ylethyl)acetamide has a molecular weight of 156.23 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-1-ylethyl)acetamide is sourced from PubChem (CID 21282553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).