3-amino-1-propan-2-yloxypyrrolidin-2-one

C7H14N2O2 — CID 59657868

IUPAC3-amino-1-propan-2-yloxypyrrolidin-2-one
SMILESCC(C)ON1CCC(N)C1=O
InChIInChI=1S/C7H14N2O2/c1-5(2)11-9-4-3-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3
InChIKeyZMVOJTZBQQYQAK-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.11
Rot. Bonds2

About 3-amino-1-propan-2-yloxypyrrolidin-2-one

3-amino-1-propan-2-yloxypyrrolidin-2-one (PubChem CID 59657868) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 3-amino-1-propan-2-yloxypyrrolidin-2-one.

Molecular Properties

Compound Name3-amino-1-propan-2-yloxypyrrolidin-2-one
PubChem CID59657868
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name3-amino-1-propan-2-yloxypyrrolidin-2-one
SMILESCC(C)ON1CCC(N)C1=O
InChIInChI=1S/C7H14N2O2/c1-5(2)11-9-4-3-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3
InChIKeyZMVOJTZBQQYQAK-UHFFFAOYSA-N
XLogP-0.11
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-propan-2-yloxypyrrolidin-2-one?
The IUPAC name of 3-amino-1-propan-2-yloxypyrrolidin-2-one (CID 59657868) is 3-amino-1-propan-2-yloxypyrrolidin-2-one.
What is the SMILES notation for 3-amino-1-propan-2-yloxypyrrolidin-2-one?
The canonical SMILES for 3-amino-1-propan-2-yloxypyrrolidin-2-one is CC(C)ON1CCC(N)C1=O.
What is the InChIKey of 3-amino-1-propan-2-yloxypyrrolidin-2-one?
The InChIKey is ZMVOJTZBQQYQAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-5(2)11-9-4-3-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3.
What are the key properties of 3-amino-1-propan-2-yloxypyrrolidin-2-one?
3-amino-1-propan-2-yloxypyrrolidin-2-one has a molecular weight of 158.20 g/mol, XLogP of -0.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-propan-2-yloxypyrrolidin-2-one is sourced from PubChem (CID 59657868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).