2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol

C18H30N2O3 — CID 45252016

IUPAC2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol
SMILESCOCc1ccc(CN2CCN(C3CCCC3)C(CCO)C2)o1
InChIInChI=1S/C18H30N2O3/c1-22-14-18-7-6-17(23-18)13-19-9-10-20(15-4-2-3-5-15)16(12-19)8-11-21/h6-7,15-16,21H,2-5,8-14H2,1H3
InChIKeyWGSNNVSSUZZIRU-UHFFFAOYSA-N
MW322.45 g/mol
LogP2.24
Rot. Bonds7

About 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol

2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol (PubChem CID 45252016) has the molecular formula C18H30N2O3 and a molecular weight of 322.45 g/mol. Its IUPAC name is 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol
PubChem CID45252016
Molecular FormulaC18H30N2O3
Molecular Weight322.45 g/mol
Exact Mass322.23
IUPAC Name2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol
SMILESCOCc1ccc(CN2CCN(C3CCCC3)C(CCO)C2)o1
InChIInChI=1S/C18H30N2O3/c1-22-14-18-7-6-17(23-18)13-19-9-10-20(15-4-2-3-5-15)16(12-19)8-11-21/h6-7,15-16,21H,2-5,8-14H2,1H3
InChIKeyWGSNNVSSUZZIRU-UHFFFAOYSA-N
XLogP2.24
TPSA49.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-cyclohexyl-4-[(5-methylfuran-2-yl)methyl]piperazin-2-yl]ethanol
CID 45187220
2-[1-benzyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol
CID 126460832
2-[1-[(3,5-dimethoxyphenyl)methyl]-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol
CID 45238988
2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol
CID 51906840
2-[(2R)-1-cyclopentyl-4-[(4-methoxy-2,3-dimethylphenyl)methyl]piperazin-2-yl]ethanol
CID 51909267
(4aR,8aS)-2-[[5-(methoxymethyl)furan-2-yl]methyl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
CID 129419127
(4aS,8aS)-2-[[5-(methoxymethyl)furan-2-yl]methyl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
CID 129419126
2-[1-cyclopentyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-2-yl]ethanol
CID 45224960
2-[(2S)-1-cyclopentyl-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-2-yl]ethanol
CID 30727850
2-[(2R)-1-cyclopentyl-4-[(2-methylphenyl)methyl]piperazin-2-yl]ethanol
CID 51902901
2-[(2R)-1-cyclopentyl-4-[(4-methoxy-3-methylphenyl)methyl]piperazin-2-yl]ethanol
CID 51908762
5-[[(3S)-4-cyclopentyl-3-(2-hydroxyethyl)piperazin-1-yl]methyl]-2-methoxyphenol
CID 29154220

Frequently Asked Questions

What is the IUPAC name of 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol?
The IUPAC name of 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol (CID 45252016) is 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol.
What is the SMILES notation for 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol?
The canonical SMILES for 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol is COCc1ccc(CN2CCN(C3CCCC3)C(CCO)C2)o1.
What is the InChIKey of 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol?
The InChIKey is WGSNNVSSUZZIRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O3/c1-22-14-18-7-6-17(23-18)13-19-9-10-20(15-4-2-3-5-15)16(12-19)8-11-21/h6-7,15-16,21H,2-5,8-14H2,1H3.
What are the key properties of 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol?
2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol has a molecular weight of 322.45 g/mol, XLogP of 2.24, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-cyclopentyl-4-[[5-(methoxymethyl)furan-2-yl]methyl]piperazin-2-yl]ethanol is sourced from PubChem (CID 45252016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).