[(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate

C10H14O2 — CID 56590409

IUPAC[(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate
SMILESC=C(C)C1=C[C@H](OC(C)=O)CC1
InChIInChI=1S/C10H14O2/c1-7(2)9-4-5-10(6-9)12-8(3)11/h6,10H,1,4-5H2,2-3H3/t10-/m1/s1
InChIKeyNZTGEPHTMPHBMQ-SNVBAGLBSA-N
MW166.22 g/mol
LogP2.21
Rot. Bonds2

About [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate

[(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate (PubChem CID 56590409) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate.

Molecular Properties

Compound Name[(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate
PubChem CID56590409
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name[(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate
SMILESC=C(C)C1=C[C@H](OC(C)=O)CC1
InChIInChI=1S/C10H14O2/c1-7(2)9-4-5-10(6-9)12-8(3)11/h6,10H,1,4-5H2,2-3H3/t10-/m1/s1
InChIKeyNZTGEPHTMPHBMQ-SNVBAGLBSA-N
XLogP2.21
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S)-3-(3-trimethylsilylprop-1-en-2-yl)cyclopent-2-en-1-yl] acetate
CID 10966588
(3-methylcyclopent-2-en-1-yl) 2-methylprop-2-enoate
CID 90261977
(3-prop-1-ynylcyclopent-2-en-1-yl) acetate
CID 145260813
(3-acetyloxycyclopenten-1-yl) propanoate
CID 175261459
[(1R)-3-bromocyclohept-2-en-1-yl] acetate
CID 11333750
[(1R)-3-[(E)-2-methoxyethenyl]cyclohex-2-en-1-yl] acetate
CID 101022571
3-ethyl-1-prop-1-en-2-ylcyclopentene
CID 90736766
[(2E,6E,10E)-3,7,11-trimethylcyclotetradeca-2,6,10-trien-1-yl] acetate
CID 134735458
[(6R,8aS)-3,4,6,7,8,8a-hexahydro-2H-chromen-6-yl] acetate
CID 11074321
(3-iodocyclohex-2-en-1-yl) 2-methylprop-2-enoate
CID 176878239
(5-methyl-2,3-dihydrofuran-3-yl) acetate
CID 57066065
(4-chlorocyclohept-2-en-1-yl) acetate
CID 12936437

Frequently Asked Questions

What is the IUPAC name of [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate?
The IUPAC name of [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate (CID 56590409) is [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate.
What is the SMILES notation for [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate?
The canonical SMILES for [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate is C=C(C)C1=C[C@H](OC(C)=O)CC1.
What is the InChIKey of [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate?
The InChIKey is NZTGEPHTMPHBMQ-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H14O2/c1-7(2)9-4-5-10(6-9)12-8(3)11/h6,10H,1,4-5H2,2-3H3/t10-/m1/s1.
What are the key properties of [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate?
[(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate has a molecular weight of 166.22 g/mol, XLogP of 2.21, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-3-prop-1-en-2-ylcyclopent-2-en-1-yl] acetate is sourced from PubChem (CID 56590409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).