cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride

C6H12ClNO2 — CID 2733976

IUPACcis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride
SMILESCl.N[C@H]1CCC[C@H]1C(=O)O
InChIInChI=1S/C6H11NO2.ClH/c7-5-3-1-2-4(5)6(8)9;/h4-5H,1-3,7H2,(H,8,9);1H/t4-,5+;/m1./s1
InChIKeyLVBDVNLIEHCCTP-JBUOLDKXSA-N
MW165.62 g/mol
LogP0.62
Rot. Bonds1

About cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride

cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride (PubChem CID 2733976) has the molecular formula C6H12ClNO2 and a molecular weight of 165.62 g/mol. Its IUPAC name is cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride.

Molecular Properties

Compound Namecis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride
PubChem CID2733976
Molecular FormulaC6H12ClNO2
Molecular Weight165.62 g/mol
Exact Mass165.06
IUPAC Namecis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride
SMILESCl.N[C@H]1CCC[C@H]1C(=O)O
InChIInChI=1S/C6H11NO2.ClH/c7-5-3-1-2-4(5)6(8)9;/h4-5H,1-3,7H2,(H,8,9);1H/t4-,5+;/m1./s1
InChIKeyLVBDVNLIEHCCTP-JBUOLDKXSA-N
XLogP0.62
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.62
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride?
The IUPAC name of cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride (CID 2733976) is cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride.
What is the SMILES notation for cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride?
The canonical SMILES for cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride is Cl.N[C@H]1CCC[C@H]1C(=O)O.
What is the InChIKey of cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride?
The InChIKey is LVBDVNLIEHCCTP-JBUOLDKXSA-N. The full InChI is InChI=1S/C6H11NO2.ClH/c7-5-3-1-2-4(5)6(8)9;/h4-5H,1-3,7H2,(H,8,9);1H/t4-,5+;/m1./s1.
What are the key properties of cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride?
cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride has a molecular weight of 165.62 g/mol, XLogP of 0.62, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-aminocyclopentane-1-carboxylic acid;hydrochloride is sourced from PubChem (CID 2733976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).