2-(cyclopenten-1-yl)prop-2-enoic acid

C8H10O2 — CID 15807267

IUPAC2-(cyclopenten-1-yl)prop-2-enoic acid
SMILESC=C(C(=O)O)C1=CCCC1
InChIInChI=1S/C8H10O2/c1-6(8(9)10)7-4-2-3-5-7/h4H,1-3,5H2,(H,9,10)
InChIKeyKMPAJRUDGIFEAL-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.74
Rot. Bonds2

About 2-(cyclopenten-1-yl)prop-2-enoic acid

2-(cyclopenten-1-yl)prop-2-enoic acid (PubChem CID 15807267) has the molecular formula C8H10O2 and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-(cyclopenten-1-yl)prop-2-enoic acid.

Molecular Properties

Compound Name2-(cyclopenten-1-yl)prop-2-enoic acid
PubChem CID15807267
Molecular FormulaC8H10O2
Molecular Weight138.17 g/mol
Exact Mass138.07
IUPAC Name2-(cyclopenten-1-yl)prop-2-enoic acid
SMILESC=C(C(=O)O)C1=CCCC1
InChIInChI=1S/C8H10O2/c1-6(8(9)10)7-4-2-3-5-7/h4H,1-3,5H2,(H,9,10)
InChIKeyKMPAJRUDGIFEAL-UHFFFAOYSA-N
XLogP1.74
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenten-1-yl)prop-2-enoic acid?
The IUPAC name of 2-(cyclopenten-1-yl)prop-2-enoic acid (CID 15807267) is 2-(cyclopenten-1-yl)prop-2-enoic acid.
What is the SMILES notation for 2-(cyclopenten-1-yl)prop-2-enoic acid?
The canonical SMILES for 2-(cyclopenten-1-yl)prop-2-enoic acid is C=C(C(=O)O)C1=CCCC1.
What is the InChIKey of 2-(cyclopenten-1-yl)prop-2-enoic acid?
The InChIKey is KMPAJRUDGIFEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2/c1-6(8(9)10)7-4-2-3-5-7/h4H,1-3,5H2,(H,9,10).
What are the key properties of 2-(cyclopenten-1-yl)prop-2-enoic acid?
2-(cyclopenten-1-yl)prop-2-enoic acid has a molecular weight of 138.17 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenten-1-yl)prop-2-enoic acid is sourced from PubChem (CID 15807267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).