2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride

C7H15ClN2O2 — CID 138111407

IUPAC2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride
SMILESCl.NC1(CC(=O)O)CCNCC1
InChIInChI=1S/C7H14N2O2.ClH/c8-7(5-6(10)11)1-3-9-4-2-7;/h9H,1-5,8H2,(H,10,11);1H
InChIKeyJSCLXDFKGGUAOR-UHFFFAOYSA-N
MW194.66 g/mol
LogP-0.04
Rot. Bonds2

About 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride

2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride (PubChem CID 138111407) has the molecular formula C7H15ClN2O2 and a molecular weight of 194.66 g/mol. Its IUPAC name is 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride.

Molecular Properties

Compound Name2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride
PubChem CID138111407
Molecular FormulaC7H15ClN2O2
Molecular Weight194.66 g/mol
Exact Mass194.08
IUPAC Name2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride
SMILESCl.NC1(CC(=O)O)CCNCC1
InChIInChI=1S/C7H14N2O2.ClH/c8-7(5-6(10)11)1-3-9-4-2-7;/h9H,1-5,8H2,(H,10,11);1H
InChIKeyJSCLXDFKGGUAOR-UHFFFAOYSA-N
XLogP-0.04
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.66
LogP ≤ 5-0.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminopiperidin-4-yl)acetic acid
CID 18379201
2-(4-aminopiperidin-4-yl)acetamide
CID 83682139
2-(4-hydroxypiperidin-4-yl)acetic acid
CID 15565781
2-[4-(2-amino-2-oxoethyl)piperidin-4-yl]acetic acid
CID 70955898
2-(4-amino-2-oxopiperidin-4-yl)acetic acid
CID 77219916
4-aminopiperidine-4-carboxylic acid;dihydrochloride
CID 22907088
(3-aminopyrrolidin-3-yl)methanol;hydrochloride
CID 129319695
2-(3-aminopyrrolidin-3-yl)acetamide
CID 83681833
2-(1-amino-3,3-dimethylcyclopentyl)acetic acid
CID 80698917
2-(1-amino-4-methylcyclohexyl)acetic acid
CID 64664304
4-ethylpiperidin-4-amine;dihydrochloride
CID 86276736
1-(3-aminopyrrolidin-3-yl)propan-2-one
CID 115011479

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride?
The IUPAC name of 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride (CID 138111407) is 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride.
What is the SMILES notation for 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride?
The canonical SMILES for 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride is Cl.NC1(CC(=O)O)CCNCC1.
What is the InChIKey of 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride?
The InChIKey is JSCLXDFKGGUAOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2.ClH/c8-7(5-6(10)11)1-3-9-4-2-7;/h9H,1-5,8H2,(H,10,11);1H.
What are the key properties of 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride?
2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride has a molecular weight of 194.66 g/mol, XLogP of -0.04, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-4-yl)acetic acid;hydrochloride is sourced from PubChem (CID 138111407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).