2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride

C8H16ClNO2 — CID 137318121

IUPAC2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride
SMILESCN(CC(=O)O)C1CCCC1.Cl
InChIInChI=1S/C8H15NO2.ClH/c1-9(6-8(10)11)7-4-2-3-5-7;/h7H,2-6H2,1H3,(H,10,11);1H
InChIKeyVJNGUMSBQAVKOG-UHFFFAOYSA-N
MW193.67 g/mol
LogP1.37
Rot. Bonds3

About 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride

2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride (PubChem CID 137318121) has the molecular formula C8H16ClNO2 and a molecular weight of 193.67 g/mol. Its IUPAC name is 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride.

Molecular Properties

Compound Name2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride
PubChem CID137318121
Molecular FormulaC8H16ClNO2
Molecular Weight193.67 g/mol
Exact Mass193.09
IUPAC Name2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride
SMILESCN(CC(=O)O)C1CCCC1.Cl
InChIInChI=1S/C8H15NO2.ClH/c1-9(6-8(10)11)7-4-2-3-5-7;/h7H,2-6H2,1H3,(H,10,11);1H
InChIKeyVJNGUMSBQAVKOG-UHFFFAOYSA-N
XLogP1.37
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.67
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride?
The IUPAC name of 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride (CID 137318121) is 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride.
What is the SMILES notation for 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride?
The canonical SMILES for 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride is CN(CC(=O)O)C1CCCC1.Cl.
What is the InChIKey of 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride?
The InChIKey is VJNGUMSBQAVKOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2.ClH/c1-9(6-8(10)11)7-4-2-3-5-7;/h7H,2-6H2,1H3,(H,10,11);1H.
What are the key properties of 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride?
2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride has a molecular weight of 193.67 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(methyl)amino]acetic acid;hydrochloride is sourced from PubChem (CID 137318121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).