1-(3-hydroxypropyl)pyrrolidin-2-one

C7H13NO2 — CID 566744

IUPAC1-(3-hydroxypropyl)pyrrolidin-2-one
SMILESO=C1CCCN1CCCO
InChIInChI=1S/C7H13NO2/c9-6-2-5-8-4-1-3-7(8)10/h9H,1-6H2
InChIKeyCVDGNRZPDAXOQO-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.01
Rot. Bonds3

About 1-(3-hydroxypropyl)pyrrolidin-2-one

1-(3-hydroxypropyl)pyrrolidin-2-one (PubChem CID 566744) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 1-(3-hydroxypropyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(3-hydroxypropyl)pyrrolidin-2-one
PubChem CID566744
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name1-(3-hydroxypropyl)pyrrolidin-2-one
SMILESO=C1CCCN1CCCO
InChIInChI=1S/C7H13NO2/c9-6-2-5-8-4-1-3-7(8)10/h9H,1-6H2
InChIKeyCVDGNRZPDAXOQO-UHFFFAOYSA-N
XLogP-0.01
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxypropyl)pyrrolidin-2-one?
The IUPAC name of 1-(3-hydroxypropyl)pyrrolidin-2-one (CID 566744) is 1-(3-hydroxypropyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(3-hydroxypropyl)pyrrolidin-2-one?
The canonical SMILES for 1-(3-hydroxypropyl)pyrrolidin-2-one is O=C1CCCN1CCCO.
What is the InChIKey of 1-(3-hydroxypropyl)pyrrolidin-2-one?
The InChIKey is CVDGNRZPDAXOQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c9-6-2-5-8-4-1-3-7(8)10/h9H,1-6H2.
What are the key properties of 1-(3-hydroxypropyl)pyrrolidin-2-one?
1-(3-hydroxypropyl)pyrrolidin-2-one has a molecular weight of 143.19 g/mol, XLogP of -0.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxypropyl)pyrrolidin-2-one is sourced from PubChem (CID 566744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).