3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol

C17H22O3 — CID 18957483

IUPAC3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol
SMILESCOc1ccc(C2=CC(O)CC2)cc1OC1CCCC1
InChIInChI=1S/C17H22O3/c1-19-16-9-7-13(12-6-8-14(18)10-12)11-17(16)20-15-4-2-3-5-15/h7,9-11,14-15,18H,2-6,8H2,1H3
InChIKeyKNWYGRSFCXYXEG-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.55
Rot. Bonds4

About 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol

3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol (PubChem CID 18957483) has the molecular formula C17H22O3 and a molecular weight of 274.36 g/mol. Its IUPAC name is 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol.

Molecular Properties

Compound Name3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol
PubChem CID18957483
Molecular FormulaC17H22O3
Molecular Weight274.36 g/mol
Exact Mass274.16
IUPAC Name3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol
SMILESCOc1ccc(C2=CC(O)CC2)cc1OC1CCCC1
InChIInChI=1S/C17H22O3/c1-19-16-9-7-13(12-6-8-14(18)10-12)11-17(16)20-15-4-2-3-5-15/h7,9-11,14-15,18H,2-6,8H2,1H3
InChIKeyKNWYGRSFCXYXEG-UHFFFAOYSA-N
XLogP3.55
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopentyloxy-1-methoxy-4-(3-methoxyphenyl)benzene
CID 18778852
(4R)-4-[3-(3-cyclopentyloxy-4-methoxyphenyl)phenyl]-2-hydroxyoxaborolane
CID 156900450
2-cyclopentyloxy-1-methoxy-4-(4-nitrophenyl)benzene
CID 18778842
2-cyclopentyloxy-1-methoxy-4-methylbenzene;ethane
CID 142884364
2-cyclopentyloxy-4-iodo-1-methoxybenzene
CID 11197924
bis[2-(3-cyclopentyloxy-4-methoxyphenyl)phenyl]methanone
CID 67693091
4-(3-cyclopentyloxy-4-methoxyphenyl)-2-methylpyridin-3-ol
CID 57267140
N-[3-(3-cyclopentyloxy-4-methoxyphenyl)phenyl]acetamide
CID 21472770
2-(3-cyclopentyloxy-4-methoxyphenyl)-4,5-dihydro-1,3-oxazole
CID 1236370
1-[3-(3-cyclopentyloxy-4-methoxyphenyl)-1,2-oxazol-5-yl]ethanol
CID 118305351
4-(3-cyclopentyloxy-4-methoxyphenyl)-5-methyl-1,3-thiazole
CID 139664304
4-(3-cyclopentyloxy-4-methoxyphenyl)-1,3-dihydroimidazol-2-one
CID 54226291

Frequently Asked Questions

What is the IUPAC name of 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol?
The IUPAC name of 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol (CID 18957483) is 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol.
What is the SMILES notation for 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol?
The canonical SMILES for 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol is COc1ccc(C2=CC(O)CC2)cc1OC1CCCC1.
What is the InChIKey of 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol?
The InChIKey is KNWYGRSFCXYXEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22O3/c1-19-16-9-7-13(12-6-8-14(18)10-12)11-17(16)20-15-4-2-3-5-15/h7,9-11,14-15,18H,2-6,8H2,1H3.
What are the key properties of 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol?
3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol has a molecular weight of 274.36 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclopentyloxy-4-methoxyphenyl)cyclopent-2-en-1-ol is sourced from PubChem (CID 18957483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).