cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone

C12H18O2 — CID 106652335

IUPACcyclohexen-1-yl-(1-hydroxycyclopentyl)methanone
SMILESO=C(C1=CCCCC1)C1(O)CCCC1
InChIInChI=1S/C12H18O2/c13-11(10-6-2-1-3-7-10)12(14)8-4-5-9-12/h6,14H,1-5,7-9H2
InChIKeyFPHAMHRMYBLSKR-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.36
Rot. Bonds2

About cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone

cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone (PubChem CID 106652335) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone.

Molecular Properties

Compound Namecyclohexen-1-yl-(1-hydroxycyclopentyl)methanone
PubChem CID106652335
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Namecyclohexen-1-yl-(1-hydroxycyclopentyl)methanone
SMILESO=C(C1=CCCCC1)C1(O)CCCC1
InChIInChI=1S/C12H18O2/c13-11(10-6-2-1-3-7-10)12(14)8-4-5-9-12/h6,14H,1-5,7-9H2
InChIKeyFPHAMHRMYBLSKR-UHFFFAOYSA-N
XLogP2.36
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexen-1-yl-[1-(dimethylamino)cyclopentyl]methanone
CID 106652002
cycloocten-1-yl-(1-methoxycyclohexyl)methanone
CID 106652256
cyclohepten-1-yl-(1-methoxycyclopentyl)methanone
CID 106652202
cycloocten-1-yl-(1-pyrrolidin-1-ylcyclopentyl)methanone
CID 106652005
1-(cyclohexen-1-yl)propane-1,2-dione
CID 68719323
cycloocten-1-yl-(3-methylpyrrolidin-3-yl)methanone
CID 106655318
[1-(aminomethyl)cyclobutyl]-(cycloocten-1-yl)methanone
CID 106655611
cycloheptene-1-carboxamide
CID 22261654
N-(1-methylcyclopropyl)cyclohexene-1-carboxamide
CID 130625889
aluminum tris(cycloheptene-1-carboxylate)
CID 22604888
cycloocten-1-yl-(4-methoxyoxan-4-yl)methanone
CID 106652262
2-[1-(aminomethyl)cyclohexyl]-1-(cyclohexen-1-yl)ethanone
CID 106655745

Frequently Asked Questions

What is the IUPAC name of cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone?
The IUPAC name of cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone (CID 106652335) is cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone.
What is the SMILES notation for cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone?
The canonical SMILES for cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone is O=C(C1=CCCCC1)C1(O)CCCC1.
What is the InChIKey of cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone?
The InChIKey is FPHAMHRMYBLSKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c13-11(10-6-2-1-3-7-10)12(14)8-4-5-9-12/h6,14H,1-5,7-9H2.
What are the key properties of cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone?
cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone has a molecular weight of 194.27 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone is sourced from PubChem (CID 106652335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).