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

C9H16N2O2 — CID 28815490

IUPAC(4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one
SMILESN[C@@H]1CC(=O)N(C[C@H]2CCCO2)C1
InChIInChI=1S/C9H16N2O2/c10-7-4-9(12)11(5-7)6-8-2-1-3-13-8/h7-8H,1-6,10H2/t7-,8-/m1/s1
InChIKeyQSPCVZTTZMXNIC-HTQZYQBOSA-N
MW184.24 g/mol
LogP-0.28
Rot. Bonds2

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

(4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one (PubChem CID 28815490) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is (4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one
PubChem CID28815490
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name(4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one
SMILESN[C@@H]1CC(=O)N(C[C@H]2CCCO2)C1
InChIInChI=1S/C9H16N2O2/c10-7-4-9(12)11(5-7)6-8-2-1-3-13-8/h7-8H,1-6,10H2/t7-,8-/m1/s1
InChIKeyQSPCVZTTZMXNIC-HTQZYQBOSA-N
XLogP-0.28
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-1-(oxolan-2-ylmethyl)pyrrolidin-2-one
CID 168687103
4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one
CID 114401064
1-(oxolan-2-ylmethyl)azetidin-3-amine
CID 63760708
1-(oxolan-2-ylmethyl)piperazine-2,5-dione
CID 64872858
N-(4-methylphenyl)-5-oxo-1-(oxolan-2-ylmethyl)pyrrolidine-3-carboxamide
CID 113182716
N-(4-chlorophenyl)-5-oxo-1-(oxolan-2-ylmethyl)pyrrolidine-3-carboxamide
CID 113182741
4-(oxan-2-ylmethyl)-5-oxomorpholine-2-carboxylic acid
CID 115103049
1-(oxolan-2-ylmethyl)piperazine-2,6-dione
CID 64982518
1-(oxolan-2-ylmethyl)-1,5-diazocan-2-one
CID 117014385
1-methyl-3-(oxolan-2-ylmethyl)imidazolidin-2-one
CID 117026456
N-(2-morpholin-4-ylethyl)-5-oxo-1-(oxolan-2-ylmethyl)pyrrolidine-3-carboxamide
CID 113182640
4-[5-oxo-4-(oxolan-2-ylmethyl)morpholin-2-yl]butanoic acid
CID 112519843

Frequently Asked Questions

What is the IUPAC name of (4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one?
The IUPAC name of (4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one (CID 28815490) is (4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one.
What is the SMILES notation for (4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one?
The canonical SMILES for (4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one is N[C@@H]1CC(=O)N(C[C@H]2CCCO2)C1.
What is the InChIKey of (4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one?
The InChIKey is QSPCVZTTZMXNIC-HTQZYQBOSA-N. The full InChI is InChI=1S/C9H16N2O2/c10-7-4-9(12)11(5-7)6-8-2-1-3-13-8/h7-8H,1-6,10H2/t7-,8-/m1/s1.
What are the key properties of (4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one?
(4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one has a molecular weight of 184.24 g/mol, XLogP of -0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one is sourced from PubChem (CID 28815490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).