4-amino-6-oxopiperidine-2-carboxylic acid

C6H10N2O3 — CID 71777683

IUPAC4-amino-6-oxopiperidine-2-carboxylic acid
SMILESNC1CC(=O)NC(C(=O)O)C1
InChIInChI=1S/C6H10N2O3/c7-3-1-4(6(10)11)8-5(9)2-3/h3-4H,1-2,7H2,(H,8,9)(H,10,11)
InChIKeyZYTHBEQVQCXRSQ-UHFFFAOYSA-N
MW158.16 g/mol
LogP-1.32
Rot. Bonds1

About 4-amino-6-oxopiperidine-2-carboxylic acid

4-amino-6-oxopiperidine-2-carboxylic acid (PubChem CID 71777683) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is 4-amino-6-oxopiperidine-2-carboxylic acid.

Molecular Properties

Compound Name4-amino-6-oxopiperidine-2-carboxylic acid
PubChem CID71777683
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC Name4-amino-6-oxopiperidine-2-carboxylic acid
SMILESNC1CC(=O)NC(C(=O)O)C1
InChIInChI=1S/C6H10N2O3/c7-3-1-4(6(10)11)8-5(9)2-3/h3-4H,1-2,7H2,(H,8,9)(H,10,11)
InChIKeyZYTHBEQVQCXRSQ-UHFFFAOYSA-N
XLogP-1.32
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-1.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-6-oxopiperidine-2-carboxylic acid?
The IUPAC name of 4-amino-6-oxopiperidine-2-carboxylic acid (CID 71777683) is 4-amino-6-oxopiperidine-2-carboxylic acid.
What is the SMILES notation for 4-amino-6-oxopiperidine-2-carboxylic acid?
The canonical SMILES for 4-amino-6-oxopiperidine-2-carboxylic acid is NC1CC(=O)NC(C(=O)O)C1.
What is the InChIKey of 4-amino-6-oxopiperidine-2-carboxylic acid?
The InChIKey is ZYTHBEQVQCXRSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c7-3-1-4(6(10)11)8-5(9)2-3/h3-4H,1-2,7H2,(H,8,9)(H,10,11).
What are the key properties of 4-amino-6-oxopiperidine-2-carboxylic acid?
4-amino-6-oxopiperidine-2-carboxylic acid has a molecular weight of 158.16 g/mol, XLogP of -1.32, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-oxopiperidine-2-carboxylic acid is sourced from PubChem (CID 71777683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).