3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one

C10H18N2O3 — CID 65313580

IUPAC3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one
SMILESO=C1C(NC2CC2)CCN1C(CO)CO
InChIInChI=1S/C10H18N2O3/c13-5-8(6-14)12-4-3-9(10(12)15)11-7-1-2-7/h7-9,11,13-14H,1-6H2
InChIKeyKGBYIDOSCVONQA-UHFFFAOYSA-N
MW214.26 g/mol
LogP-1.31
Rot. Bonds5

About 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one

3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one (PubChem CID 65313580) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one
PubChem CID65313580
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one
SMILESO=C1C(NC2CC2)CCN1C(CO)CO
InChIInChI=1S/C10H18N2O3/c13-5-8(6-14)12-4-3-9(10(12)15)11-7-1-2-7/h7-9,11,13-14H,1-6H2
InChIKeyKGBYIDOSCVONQA-UHFFFAOYSA-N
XLogP-1.31
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-1.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one?
The IUPAC name of 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one (CID 65313580) is 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one.
What is the SMILES notation for 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one?
The canonical SMILES for 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one is O=C1C(NC2CC2)CCN1C(CO)CO.
What is the InChIKey of 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one?
The InChIKey is KGBYIDOSCVONQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c13-5-8(6-14)12-4-3-9(10(12)15)11-7-1-2-7/h7-9,11,13-14H,1-6H2.
What are the key properties of 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one?
3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one has a molecular weight of 214.26 g/mol, XLogP of -1.31, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-2-one is sourced from PubChem (CID 65313580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).