methyl 2-amino-2-cyclopentylacetate;hydrochloride

C8H16ClNO2 — CID 68897405

IUPACmethyl 2-amino-2-cyclopentylacetate;hydrochloride
SMILESCOC(=O)C(N)C1CCCC1.Cl
InChIInChI=1S/C8H15NO2.ClH/c1-11-8(10)7(9)6-4-2-3-5-6;/h6-7H,2-5,9H2,1H3;1H
InChIKeyOQEFEOSHQDCMLN-UHFFFAOYSA-N
MW193.67 g/mol
LogP1.10
Rot. Bonds2

About methyl 2-amino-2-cyclopentylacetate;hydrochloride

methyl 2-amino-2-cyclopentylacetate;hydrochloride (PubChem CID 68897405) has the molecular formula C8H16ClNO2 and a molecular weight of 193.67 g/mol. Its IUPAC name is methyl 2-amino-2-cyclopentylacetate;hydrochloride.

Molecular Properties

Compound Namemethyl 2-amino-2-cyclopentylacetate;hydrochloride
PubChem CID68897405
Molecular FormulaC8H16ClNO2
Molecular Weight193.67 g/mol
Exact Mass193.09
IUPAC Namemethyl 2-amino-2-cyclopentylacetate;hydrochloride
SMILESCOC(=O)C(N)C1CCCC1.Cl
InChIInChI=1S/C8H15NO2.ClH/c1-11-8(10)7(9)6-4-2-3-5-6;/h6-7H,2-5,9H2,1H3;1H
InChIKeyOQEFEOSHQDCMLN-UHFFFAOYSA-N
XLogP1.10
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.67
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Methylbutyl 2-amino-6,6-dimethylheptanoate--hydrogen chloride (1/1)
CID 42779
Ethyl 2-amino-3-cyclohexylpropanoate hydrochloride
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H-Cha-OMe hydrochloride
CID 13833919
2-Amino-2-cyclopentylacetic acid hydrochloride
CID 18926642
2-Amino-4-methylheptanoic acid
CID 21943660
Methyl 2-amino-2-cyclohexylacetate hydrochloride
CID 22259438
Ethyl 2-amino-2-cyclohexylacetate hydrochloride
CID 22492156
methyl (2S)-2-amino-3-cyclohexylpropanoate hydrochloride
CID 22861687
Ethyl 2-amino-3-cyclobutylpropanoate
CID 23594366
(S)-Amino-Cyclopentyl-Acetic Acid Methyl Ester Hydrochloride
CID 51358379
Methyl 2-amino-4-(oxan-4-yl)butanoate hydrochloride
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Methyl 3-cyclohexyl-D-alaninate--hydrogen chloride (1/1)
CID 56777179

Frequently Asked Questions

What is the IUPAC name of methyl 2-amino-2-cyclopentylacetate;hydrochloride?
The IUPAC name of methyl 2-amino-2-cyclopentylacetate;hydrochloride (CID 68897405) is methyl 2-amino-2-cyclopentylacetate;hydrochloride.
What is the SMILES notation for methyl 2-amino-2-cyclopentylacetate;hydrochloride?
The canonical SMILES for methyl 2-amino-2-cyclopentylacetate;hydrochloride is COC(=O)C(N)C1CCCC1.Cl.
What is the InChIKey of methyl 2-amino-2-cyclopentylacetate;hydrochloride?
The InChIKey is OQEFEOSHQDCMLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2.ClH/c1-11-8(10)7(9)6-4-2-3-5-6;/h6-7H,2-5,9H2,1H3;1H.
What are the key properties of methyl 2-amino-2-cyclopentylacetate;hydrochloride?
methyl 2-amino-2-cyclopentylacetate;hydrochloride has a molecular weight of 193.67 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-amino-2-cyclopentylacetate;hydrochloride is sourced from PubChem (CID 68897405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).