2-piperidin-2-ylacetic acid;hydrochloride

C7H14ClNO2 — CID 12514712

IUPAC2-piperidin-2-ylacetic acid;hydrochloride
SMILESCl.O=C(O)CC1CCCCN1
InChIInChI=1S/C7H13NO2.ClH/c9-7(10)5-6-3-1-2-4-8-6;/h6,8H,1-5H2,(H,9,10);1H
InChIKeyDJEVRGSQHJHEKA-UHFFFAOYSA-N
MW179.65 g/mol
LogP1.02
Rot. Bonds2

About 2-piperidin-2-ylacetic acid;hydrochloride

2-piperidin-2-ylacetic acid;hydrochloride (PubChem CID 12514712) has the molecular formula C7H14ClNO2 and a molecular weight of 179.65 g/mol. Its IUPAC name is 2-piperidin-2-ylacetic acid;hydrochloride.

Molecular Properties

Compound Name2-piperidin-2-ylacetic acid;hydrochloride
PubChem CID12514712
Molecular FormulaC7H14ClNO2
Molecular Weight179.65 g/mol
Exact Mass179.07
IUPAC Name2-piperidin-2-ylacetic acid;hydrochloride
SMILESCl.O=C(O)CC1CCCCN1
InChIInChI=1S/C7H13NO2.ClH/c9-7(10)5-6-3-1-2-4-8-6;/h6,8H,1-5H2,(H,9,10);1H
InChIKeyDJEVRGSQHJHEKA-UHFFFAOYSA-N
XLogP1.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.65
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Piperidin-2-yl)acetic acid
CID 3164325
2,6-Piperidinedicarboxylic acid
CID 557515
dl-Pipecolic acid hcl
CID 85923
cis-Piperidine-2,6-dicarboxylic acid
CID 10942932
3-(Piperidin-2-yl)propanoic acid hydrochloride
CID 42614381
NoName_3265
CID 3815667
Methyl 2-(piperidin-2-yl)acetate hydrochloride
CID 13778732
2-(6-Oxopiperidin-2-yl)acetic acid
CID 14507691
2-(1-Methylpiperidin-2-yl)acetic acid hydrochloride
CID 45156844
2-((2S)-piperidin-2-yl)acetic acid hydrochloride
CID 118235722
(S)-2-(Piperidin-2-yl)acetic acid
CID 854351
Methyl piperidin-2-ylacetate
CID 5214606

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-ylacetic acid;hydrochloride?
The IUPAC name of 2-piperidin-2-ylacetic acid;hydrochloride (CID 12514712) is 2-piperidin-2-ylacetic acid;hydrochloride.
What is the SMILES notation for 2-piperidin-2-ylacetic acid;hydrochloride?
The canonical SMILES for 2-piperidin-2-ylacetic acid;hydrochloride is Cl.O=C(O)CC1CCCCN1.
What is the InChIKey of 2-piperidin-2-ylacetic acid;hydrochloride?
The InChIKey is DJEVRGSQHJHEKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2.ClH/c9-7(10)5-6-3-1-2-4-8-6;/h6,8H,1-5H2,(H,9,10);1H.
What are the key properties of 2-piperidin-2-ylacetic acid;hydrochloride?
2-piperidin-2-ylacetic acid;hydrochloride has a molecular weight of 179.65 g/mol, XLogP of 1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-ylacetic acid;hydrochloride is sourced from PubChem (CID 12514712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).