4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one

C7H14N2O2 — CID 131038054

IUPAC4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one
SMILESC[C@H](CO)N1CC(N)CC1=O
InChIInChI=1S/C7H14N2O2/c1-5(4-10)9-3-6(8)2-7(9)11/h5-6,10H,2-4,8H2,1H3/t5-,6?/m1/s1
InChIKeyRNCQMIXZMNAZOC-LWOQYNTDSA-N
MW158.20 g/mol
LogP-1.07
Rot. Bonds2

About 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one

4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one (PubChem CID 131038054) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one
PubChem CID131038054
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one
SMILESC[C@H](CO)N1CC(N)CC1=O
InChIInChI=1S/C7H14N2O2/c1-5(4-10)9-3-6(8)2-7(9)11/h5-6,10H,2-4,8H2,1H3/t5-,6?/m1/s1
InChIKeyRNCQMIXZMNAZOC-LWOQYNTDSA-N
XLogP-1.07
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[(2S)-1-hydroxypropan-2-yl]-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168680344
4-amino-1-[(2R)-1-hydroxybutan-2-yl]pyrrolidin-2-one
CID 130617471
(2S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-methylbutanoic acid
CID 168698750
(2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid
CID 168698683
3-[4-(aminomethyl)-2-oxopyrrolidin-1-yl]butanoic acid
CID 168658772
(2R)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-sulfanylpropanoic acid
CID 168698989
4-amino-1-(3-hydroxy-1-phenylpropyl)pyrrolidin-2-one
CID 168698922
S-[[1-[(2R)-4-hydroxybutan-2-yl]-5-oxopyrrolidin-3-yl]methyl] ethanethioate
CID 168666028
4-(aminomethyl)-1-propan-2-ylpyrrolidin-2-one
CID 44827665
1-(1,1-difluoropropan-2-yl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 130979524
1-(3,3-dimethylbutan-2-yl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 104830094
[1-[(2S)-1-hydroxy-3,3-dimethylbutan-2-yl]-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168680182

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one?
The IUPAC name of 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one (CID 131038054) is 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one.
What is the SMILES notation for 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one?
The canonical SMILES for 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one is C[C@H](CO)N1CC(N)CC1=O.
What is the InChIKey of 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one?
The InChIKey is RNCQMIXZMNAZOC-LWOQYNTDSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-5(4-10)9-3-6(8)2-7(9)11/h5-6,10H,2-4,8H2,1H3/t5-,6?/m1/s1.
What are the key properties of 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one?
4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one has a molecular weight of 158.20 g/mol, XLogP of -1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one is sourced from PubChem (CID 131038054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).