3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid

C8H14N2O4 — CID 141278051

IUPAC3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid
SMILESC[C@@H](OC1CCN(C(=O)O)C1)C(N)=O
InChIInChI=1S/C8H14N2O4/c1-5(7(9)11)14-6-2-3-10(4-6)8(12)13/h5-6H,2-4H2,1H3,(H2,9,11)(H,12,13)/t5-,6?/m1/s1
InChIKeyKLJNZDTXVSEGCU-LWOQYNTDSA-N
MW202.21 g/mol
LogP-0.37
Rot. Bonds3

About 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid

3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid (PubChem CID 141278051) has the molecular formula C8H14N2O4 and a molecular weight of 202.21 g/mol. Its IUPAC name is 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid.

Molecular Properties

Compound Name3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid
PubChem CID141278051
Molecular FormulaC8H14N2O4
Molecular Weight202.21 g/mol
Exact Mass202.10
IUPAC Name3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid
SMILESC[C@@H](OC1CCN(C(=O)O)C1)C(N)=O
InChIInChI=1S/C8H14N2O4/c1-5(7(9)11)14-6-2-3-10(4-6)8(12)13/h5-6H,2-4H2,1H3,(H2,9,11)(H,12,13)/t5-,6?/m1/s1
InChIKeyKLJNZDTXVSEGCU-LWOQYNTDSA-N
XLogP-0.37
TPSA92.86 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[5-[(2-methylpropan-2-yl)oxy]-3,5-dioxopentan-2-yl]oxypyrrolidine-1-carboxylic acid
CID 175139351
(3S)-3-(dimethylcarbamoyloxy)pyrrolidine-1-carboxylic acid
CID 135304476
2-methyl-1-(3-propan-2-yloxypyrrolidin-1-yl)propan-1-one
CID 140629108
(3S)-3-(2,2-dimethylpropylsulfonyloxy)pyrrolidine-1-carboxylic acid
CID 87292695
(3R)-3-(2,2-dimethylpropylsulfonyloxy)pyrrolidine-1-carboxylic acid
CID 87292136
4-(1-chloroethoxycarbonyloxy)piperidine-1-carboxylic acid
CID 174211543
[1-(2-methylpropanoyl)pyrrolidin-3-yl] hypoiodite
CID 138648412
2-pyrrolidin-3-yloxypropanamide
CID 62327738
oxetan-3-yl-[(3S)-3-propan-2-yloxypyrrolidin-1-yl]methanone
CID 121261750
(3R,4R)-4-(1-aminoethyl)-3-methylpiperidine-1-carboxylic acid
CID 166745718
(2S)-2-amino-1-[(3R)-3-methoxypyrrolidin-1-yl]propan-1-one
CID 66564457
(3R)-3-aminopyrrolidine-1-carboxylic acid
CID 15336894

Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid?
The IUPAC name of 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid (CID 141278051) is 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid.
What is the SMILES notation for 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid?
The canonical SMILES for 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid is C[C@@H](OC1CCN(C(=O)O)C1)C(N)=O.
What is the InChIKey of 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid?
The InChIKey is KLJNZDTXVSEGCU-LWOQYNTDSA-N. The full InChI is InChI=1S/C8H14N2O4/c1-5(7(9)11)14-6-2-3-10(4-6)8(12)13/h5-6H,2-4H2,1H3,(H2,9,11)(H,12,13)/t5-,6?/m1/s1.
What are the key properties of 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid?
3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid has a molecular weight of 202.21 g/mol, XLogP of -0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-1-amino-1-oxopropan-2-yl]oxypyrrolidine-1-carboxylic acid is sourced from PubChem (CID 141278051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).