2-amino-2-cyclopent-2-en-1-ylpropanoic acid

C8H13NO2 — CID 130987040

IUPAC2-amino-2-cyclopent-2-en-1-ylpropanoic acid
SMILESCC(N)(C(=O)O)C1C=CCC1
InChIInChI=1S/C8H13NO2/c1-8(9,7(10)11)6-4-2-3-5-6/h2,4,6H,3,5,9H2,1H3,(H,10,11)
InChIKeyBUDXJLITDQPLKE-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.75
Rot. Bonds2

About 2-amino-2-cyclopent-2-en-1-ylpropanoic acid

2-amino-2-cyclopent-2-en-1-ylpropanoic acid (PubChem CID 130987040) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-amino-2-cyclopent-2-en-1-ylpropanoic acid.

Molecular Properties

Compound Name2-amino-2-cyclopent-2-en-1-ylpropanoic acid
PubChem CID130987040
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name2-amino-2-cyclopent-2-en-1-ylpropanoic acid
SMILESCC(N)(C(=O)O)C1C=CCC1
InChIInChI=1S/C8H13NO2/c1-8(9,7(10)11)6-4-2-3-5-6/h2,4,6H,3,5,9H2,1H3,(H,10,11)
InChIKeyBUDXJLITDQPLKE-UHFFFAOYSA-N
XLogP0.75
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Amino(cyclopent-2-en-1-yl)acetic acid
CID 336897
alpha-Amino-3-cyclohexene-1-acetic acid
CID 90911
(s)-2-Amino-2-methylhept-6-enoic acid
CID 16043571
2-Amino-2-(cyclohex-3-en-1-yl)acetic acid hydrochloride
CID 138987606
(R)-2-amino-2-methylhept-6-enoic acid
CID 58571237
(2S,6E)-2-amino-2-methylnon-6-enoic acid
CID 146681155
(2S)-2-amino-2-cyclopent-2-en-1-ylacetic acid
CID 15601384
Alpha-Methyldihydrophenylalanine
CID 129890460
(2S)-2-amino-2-[(1R,4R)-4-methylcyclopent-2-en-1-yl]acetic acid
CID 11252133
2-Amino-2-(2-methylpropyl)pent-4-enoic acid
CID 14702093
1-Amino-3-methylcyclopent-3-ene-1-carboxylic acid
CID 19077646
1-Amino-3-methylcyclopent-2-ene-1-carboxylic acid
CID 19077668

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopent-2-en-1-ylpropanoic acid?
The IUPAC name of 2-amino-2-cyclopent-2-en-1-ylpropanoic acid (CID 130987040) is 2-amino-2-cyclopent-2-en-1-ylpropanoic acid.
What is the SMILES notation for 2-amino-2-cyclopent-2-en-1-ylpropanoic acid?
The canonical SMILES for 2-amino-2-cyclopent-2-en-1-ylpropanoic acid is CC(N)(C(=O)O)C1C=CCC1.
What is the InChIKey of 2-amino-2-cyclopent-2-en-1-ylpropanoic acid?
The InChIKey is BUDXJLITDQPLKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-8(9,7(10)11)6-4-2-3-5-6/h2,4,6H,3,5,9H2,1H3,(H,10,11).
What are the key properties of 2-amino-2-cyclopent-2-en-1-ylpropanoic acid?
2-amino-2-cyclopent-2-en-1-ylpropanoic acid has a molecular weight of 155.20 g/mol, XLogP of 0.75, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopent-2-en-1-ylpropanoic acid is sourced from PubChem (CID 130987040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).