2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide

C12H21N3O2 — CID 54863219

IUPAC2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide
SMILESCC(CN1CCCC1=O)NC(=O)CNC1CC1
InChIInChI=1S/C12H21N3O2/c1-9(8-15-6-2-3-12(15)17)14-11(16)7-13-10-4-5-10/h9-10,13H,2-8H2,1H3,(H,14,16)
InChIKeyNBRFBESWDCWWIJ-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.13
Rot. Bonds6

About 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide

2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide (PubChem CID 54863219) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide
PubChem CID54863219
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide
SMILESCC(CN1CCCC1=O)NC(=O)CNC1CC1
InChIInChI=1S/C12H21N3O2/c1-9(8-15-6-2-3-12(15)17)14-11(16)7-13-10-4-5-10/h9-10,13H,2-8H2,1H3,(H,14,16)
InChIKeyNBRFBESWDCWWIJ-UHFFFAOYSA-N
XLogP-0.13
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide?
The IUPAC name of 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide (CID 54863219) is 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide is CC(CN1CCCC1=O)NC(=O)CNC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide?
The InChIKey is NBRFBESWDCWWIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-9(8-15-6-2-3-12(15)17)14-11(16)7-13-10-4-5-10/h9-10,13H,2-8H2,1H3,(H,14,16).
What are the key properties of 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide?
2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide has a molecular weight of 239.32 g/mol, XLogP of -0.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]acetamide is sourced from PubChem (CID 54863219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).