[1-(3,4-dimethoxyphenyl)cyclopentyl]methanol

C14H20O3 — CID 13128207

IUPAC[1-(3,4-dimethoxyphenyl)cyclopentyl]methanol
SMILESCOc1ccc(C2(CO)CCCC2)cc1OC
InChIInChI=1S/C14H20O3/c1-16-12-6-5-11(9-13(12)17-2)14(10-15)7-3-4-8-14/h5-6,9,15H,3-4,7-8,10H2,1-2H3
InChIKeyNTVYWJWIOCGJFA-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.51
Rot. Bonds4

About [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol

[1-(3,4-dimethoxyphenyl)cyclopentyl]methanol (PubChem CID 13128207) has the molecular formula C14H20O3 and a molecular weight of 236.31 g/mol. Its IUPAC name is [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(3,4-dimethoxyphenyl)cyclopentyl]methanol
PubChem CID13128207
Molecular FormulaC14H20O3
Molecular Weight236.31 g/mol
Exact Mass236.14
IUPAC Name[1-(3,4-dimethoxyphenyl)cyclopentyl]methanol
SMILESCOc1ccc(C2(CO)CCCC2)cc1OC
InChIInChI=1S/C14H20O3/c1-16-12-6-5-11(9-13(12)17-2)14(10-15)7-3-4-8-14/h5-6,9,15H,3-4,7-8,10H2,1-2H3
InChIKeyNTVYWJWIOCGJFA-UHFFFAOYSA-N
XLogP2.51
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]propan-2-amine
CID 62594582
N'-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl]oxamide
CID 27262045
3-(3-cyclopentyloxy-4-methoxyphenyl)-3-(hydroxymethyl)cyclobutan-1-one
CID 23298807
4-(1-ethylcyclopentyl)-1-methoxy-2-methylbenzene
CID 143033175
N-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl]benzenesulfonamide
CID 1114580
2-amino-N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]acetamide;hydrochloride
CID 119325911
(2R)-1-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl-methylamino]-3-phenoxypropan-2-ol
CID 7088125
4-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methylamino]-4-oxobutanoate
CID 3678737
3-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]-1,1,2-trimethylguanidine
CID 111580985
[4-(3-ethyl-4-methoxyphenyl)piperidin-4-yl]methanol
CID 82480668
2-[1-(3-fluoro-4-methoxyphenyl)cyclopentyl]acetic acid
CID 82087894
N-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl]-2-(4-methoxyphenyl)acetamide
CID 1149690

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol?
The IUPAC name of [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol (CID 13128207) is [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol.
What is the SMILES notation for [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol?
The canonical SMILES for [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol is COc1ccc(C2(CO)CCCC2)cc1OC.
What is the InChIKey of [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol?
The InChIKey is NTVYWJWIOCGJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O3/c1-16-12-6-5-11(9-13(12)17-2)14(10-15)7-3-4-8-14/h5-6,9,15H,3-4,7-8,10H2,1-2H3.
What are the key properties of [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol?
[1-(3,4-dimethoxyphenyl)cyclopentyl]methanol has a molecular weight of 236.31 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dimethoxyphenyl)cyclopentyl]methanol is sourced from PubChem (CID 13128207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).