cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid

C8H11NO2 — CID 5275662

IUPACcis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid
SMILESC=C=C1C[C@H](N)[C@H](C(=O)O)C1
InChIInChI=1S/C8H11NO2/c1-2-5-3-6(8(10)11)7(9)4-5/h6-7H,1,3-4,9H2,(H,10,11)/t6-,7+/m1/s1
InChIKeyXKICYRRQYLCDHU-RQJHMYQMSA-N
MW153.18 g/mol
LogP0.52
Rot. Bonds1

About cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid

cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid (PubChem CID 5275662) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid.

Molecular Properties

Compound Namecis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid
PubChem CID5275662
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Namecis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid
SMILESC=C=C1C[C@H](N)[C@H](C(=O)O)C1
InChIInChI=1S/C8H11NO2/c1-2-5-3-6(8(10)11)7(9)4-5/h6-7H,1,3-4,9H2,(H,10,11)/t6-,7+/m1/s1
InChIKeyXKICYRRQYLCDHU-RQJHMYQMSA-N
XLogP0.52
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.52
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-amino-4-ethenylidenecyclopentane-1-carboxylic acid?
The IUPAC name of cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid (CID 5275662) is cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid.
What is the SMILES notation for cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid?
The canonical SMILES for cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid is C=C=C1C[C@H](N)[C@H](C(=O)O)C1.
What is the InChIKey of cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid?
The InChIKey is XKICYRRQYLCDHU-RQJHMYQMSA-N. The full InChI is InChI=1S/C8H11NO2/c1-2-5-3-6(8(10)11)7(9)4-5/h6-7H,1,3-4,9H2,(H,10,11)/t6-,7+/m1/s1.
What are the key properties of cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid?
cis-(1R,2S)-2-amino-4-ethenylidenecyclopentane-1-carboxylic acid has a molecular weight of 153.18 g/mol, XLogP of 0.52, 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-amino-4-ethenylidenecyclopentane-1-carboxylic acid is sourced from PubChem (CID 5275662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).