2-pyrrolidin-2-ylbutanamide

C8H16N2O — CID 69095576

IUPAC2-pyrrolidin-2-ylbutanamide
SMILESCCC(C(N)=O)C1CCCN1
InChIInChI=1S/C8H16N2O/c1-2-6(8(9)11)7-4-3-5-10-7/h6-7,10H,2-5H2,1H3,(H2,9,11)
InChIKeyBLOOFGXCAIUZQB-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.25
Rot. Bonds3

About 2-pyrrolidin-2-ylbutanamide

2-pyrrolidin-2-ylbutanamide (PubChem CID 69095576) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-pyrrolidin-2-ylbutanamide.

Molecular Properties

Compound Name2-pyrrolidin-2-ylbutanamide
PubChem CID69095576
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-pyrrolidin-2-ylbutanamide
SMILESCCC(C(N)=O)C1CCCN1
InChIInChI=1S/C8H16N2O/c1-2-6(8(9)11)7-4-3-5-10-7/h6-7,10H,2-5H2,1H3,(H2,9,11)
InChIKeyBLOOFGXCAIUZQB-UHFFFAOYSA-N
XLogP0.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 2-pyrrolidin-2-ylpropanoate
CID 12896133
2-(5-oxopyrrolidin-2-yl)butanamide
CID 90190478
1-pyrrolidin-2-ylpropan-1-ol;hydrochloride
CID 172641162
(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanamide
CID 134516134
(2S)-2-[(2S)-butan-2-yl]pyrrolidine
CID 7047855
ethyl (2R,3S)-3-hydroxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanoate
CID 101351583
2-pyrrolidin-2-ylpropylurea
CID 70245040
dimethyl 2,6-di(piperidin-2-yl)heptanedioate
CID 24838598
dimethyl 2,7-di(piperidin-2-yl)octanedioate
CID 24840701
ethyl 3-piperidin-2-ylpentanoate
CID 67315004
N-[(2R)-1-amino-1-oxobutan-2-yl]pyrrolidine-2-carboxamide
CID 163300708
dimethyl 2,6-di(piperidin-2-yl)heptanedioate;dihydrochloride
CID 24838597

Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-2-ylbutanamide?
The IUPAC name of 2-pyrrolidin-2-ylbutanamide (CID 69095576) is 2-pyrrolidin-2-ylbutanamide.
What is the SMILES notation for 2-pyrrolidin-2-ylbutanamide?
The canonical SMILES for 2-pyrrolidin-2-ylbutanamide is CCC(C(N)=O)C1CCCN1.
What is the InChIKey of 2-pyrrolidin-2-ylbutanamide?
The InChIKey is BLOOFGXCAIUZQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-2-6(8(9)11)7-4-3-5-10-7/h6-7,10H,2-5H2,1H3,(H2,9,11).
What are the key properties of 2-pyrrolidin-2-ylbutanamide?
2-pyrrolidin-2-ylbutanamide has a molecular weight of 156.23 g/mol, XLogP of 0.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-2-ylbutanamide is sourced from PubChem (CID 69095576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).