(3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid

C7H14N2O3 — CID 69465326

IUPAC(3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid
SMILESNCC1CCN(C(=O)O)C[C@@H]1O
InChIInChI=1S/C7H14N2O3/c8-3-5-1-2-9(7(11)12)4-6(5)10/h5-6,10H,1-4,8H2,(H,11,12)/t5?,6-/m0/s1
InChIKeyBTAORBPVVVYJJH-GDVGLLTNSA-N
MW174.20 g/mol
LogP-0.69
Rot. Bonds1

About (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid

(3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid (PubChem CID 69465326) has the molecular formula C7H14N2O3 and a molecular weight of 174.20 g/mol. Its IUPAC name is (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid.

Molecular Properties

Compound Name(3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid
PubChem CID69465326
Molecular FormulaC7H14N2O3
Molecular Weight174.20 g/mol
Exact Mass174.10
IUPAC Name(3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid
SMILESNCC1CCN(C(=O)O)C[C@@H]1O
InChIInChI=1S/C7H14N2O3/c8-3-5-1-2-9(7(11)12)4-6(5)10/h5-6,10H,1-4,8H2,(H,11,12)/t5?,6-/m0/s1
InChIKeyBTAORBPVVVYJJH-GDVGLLTNSA-N
XLogP-0.69
TPSA86.79 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-0.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (3R)-4-(aminomethyl)-3-hydroxypiperidine-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

Frequently Asked Questions

What is the IUPAC name of (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid?
The IUPAC name of (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid (CID 69465326) is (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid.
What is the SMILES notation for (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid?
The canonical SMILES for (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid is NCC1CCN(C(=O)O)C[C@@H]1O.
What is the InChIKey of (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid?
The InChIKey is BTAORBPVVVYJJH-GDVGLLTNSA-N. The full InChI is InChI=1S/C7H14N2O3/c8-3-5-1-2-9(7(11)12)4-6(5)10/h5-6,10H,1-4,8H2,(H,11,12)/t5?,6-/m0/s1.
What are the key properties of (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid?
(3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid has a molecular weight of 174.20 g/mol, XLogP of -0.69, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylic acid is sourced from PubChem (CID 69465326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).