cyclohexyl 2-aminoacetate;hydrochloride

C8H16ClNO2 — CID 14180607

IUPACcyclohexyl 2-aminoacetate;hydrochloride
SMILESCl.NCC(=O)OC1CCCCC1
InChIInChI=1S/C8H15NO2.ClH/c9-6-8(10)11-7-4-2-1-3-5-7;/h7H,1-6,9H2;1H
InChIKeyXRILFBYIYXXWFR-UHFFFAOYSA-N
MW193.67 g/mol
LogP1.24
Rot. Bonds2

About cyclohexyl 2-aminoacetate;hydrochloride

cyclohexyl 2-aminoacetate;hydrochloride (PubChem CID 14180607) has the molecular formula C8H16ClNO2 and a molecular weight of 193.67 g/mol. Its IUPAC name is cyclohexyl 2-aminoacetate;hydrochloride.

Molecular Properties

Compound Namecyclohexyl 2-aminoacetate;hydrochloride
PubChem CID14180607
Molecular FormulaC8H16ClNO2
Molecular Weight193.67 g/mol
Exact Mass193.09
IUPAC Namecyclohexyl 2-aminoacetate;hydrochloride
SMILESCl.NCC(=O)OC1CCCCC1
InChIInChI=1S/C8H15NO2.ClH/c9-6-8(10)11-7-4-2-1-3-5-7;/h7H,1-6,9H2;1H
InChIKeyXRILFBYIYXXWFR-UHFFFAOYSA-N
XLogP1.24
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 ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 70581321
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cyclohexyl 4-amino-3-hydroxy-3-methylbutanoate
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CID 53312802
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Frequently Asked Questions

What is the IUPAC name of cyclohexyl 2-aminoacetate;hydrochloride?
The IUPAC name of cyclohexyl 2-aminoacetate;hydrochloride (CID 14180607) is cyclohexyl 2-aminoacetate;hydrochloride.
What is the SMILES notation for cyclohexyl 2-aminoacetate;hydrochloride?
The canonical SMILES for cyclohexyl 2-aminoacetate;hydrochloride is Cl.NCC(=O)OC1CCCCC1.
What is the InChIKey of cyclohexyl 2-aminoacetate;hydrochloride?
The InChIKey is XRILFBYIYXXWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2.ClH/c9-6-8(10)11-7-4-2-1-3-5-7;/h7H,1-6,9H2;1H.
What are the key properties of cyclohexyl 2-aminoacetate;hydrochloride?
cyclohexyl 2-aminoacetate;hydrochloride has a molecular weight of 193.67 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl 2-aminoacetate;hydrochloride is sourced from PubChem (CID 14180607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).