4-amino-3-hydroxypiperidine-1-carboxylic acid

C6H12N2O3 — CID 18453271

IUPAC4-amino-3-hydroxypiperidine-1-carboxylic acid
SMILESNC1CCN(C(=O)O)CC1O
InChIInChI=1S/C6H12N2O3/c7-4-1-2-8(6(10)11)3-5(4)9/h4-5,9H,1-3,7H2,(H,10,11)
InChIKeyAGDZQYSHSWJPKP-UHFFFAOYSA-N
MW160.17 g/mol
LogP-0.94
Rot. Bonds

About 4-amino-3-hydroxypiperidine-1-carboxylic acid

4-amino-3-hydroxypiperidine-1-carboxylic acid (PubChem CID 18453271) has the molecular formula C6H12N2O3 and a molecular weight of 160.17 g/mol. Its IUPAC name is 4-amino-3-hydroxypiperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-amino-3-hydroxypiperidine-1-carboxylic acid
PubChem CID18453271
Molecular FormulaC6H12N2O3
Molecular Weight160.17 g/mol
Exact Mass160.08
IUPAC Name4-amino-3-hydroxypiperidine-1-carboxylic acid
SMILESNC1CCN(C(=O)O)CC1O
InChIInChI=1S/C6H12N2O3/c7-4-1-2-8(6(10)11)3-5(4)9/h4-5,9H,1-3,7H2,(H,10,11)
InChIKeyAGDZQYSHSWJPKP-UHFFFAOYSA-N
XLogP-0.94
TPSA86.79 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.17
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-3-hydroxypiperidine-1-carboxylic acid?
The IUPAC name of 4-amino-3-hydroxypiperidine-1-carboxylic acid (CID 18453271) is 4-amino-3-hydroxypiperidine-1-carboxylic acid.
What is the SMILES notation for 4-amino-3-hydroxypiperidine-1-carboxylic acid?
The canonical SMILES for 4-amino-3-hydroxypiperidine-1-carboxylic acid is NC1CCN(C(=O)O)CC1O.
What is the InChIKey of 4-amino-3-hydroxypiperidine-1-carboxylic acid?
The InChIKey is AGDZQYSHSWJPKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O3/c7-4-1-2-8(6(10)11)3-5(4)9/h4-5,9H,1-3,7H2,(H,10,11).
What are the key properties of 4-amino-3-hydroxypiperidine-1-carboxylic acid?
4-amino-3-hydroxypiperidine-1-carboxylic acid has a molecular weight of 160.17 g/mol, XLogP of -0.94, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-hydroxypiperidine-1-carboxylic acid is sourced from PubChem (CID 18453271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).