2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one

C11H14O2 — CID 102238858

IUPAC2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one
SMILESCO[C@@H]1CC=C(C2=CCCC2=O)C1
InChIInChI=1S/C11H14O2/c1-13-9-6-5-8(7-9)10-3-2-4-11(10)12/h3,5,9H,2,4,6-7H2,1H3/t9-/m1/s1
InChIKeyPCRUCRJIGZOEEC-SECBINFHSA-N
MW178.23 g/mol
LogP2.01
Rot. Bonds2

About 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one

2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one (PubChem CID 102238858) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one.

Molecular Properties

Compound Name2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one
PubChem CID102238858
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one
SMILESCO[C@@H]1CC=C(C2=CCCC2=O)C1
InChIInChI=1S/C11H14O2/c1-13-9-6-5-8(7-9)10-3-2-4-11(10)12/h3,5,9H,2,4,6-7H2,1H3/t9-/m1/s1
InChIKeyPCRUCRJIGZOEEC-SECBINFHSA-N
XLogP2.01
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one?
The IUPAC name of 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one (CID 102238858) is 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one.
What is the SMILES notation for 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one?
The canonical SMILES for 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one is CO[C@@H]1CC=C(C2=CCCC2=O)C1.
What is the InChIKey of 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one?
The InChIKey is PCRUCRJIGZOEEC-SECBINFHSA-N. The full InChI is InChI=1S/C11H14O2/c1-13-9-6-5-8(7-9)10-3-2-4-11(10)12/h3,5,9H,2,4,6-7H2,1H3/t9-/m1/s1.
What are the key properties of 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one?
2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one has a molecular weight of 178.23 g/mol, XLogP of 2.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-4-methoxycyclopenten-1-yl]cyclopent-2-en-1-one is sourced from PubChem (CID 102238858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).