3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol

C17H26N2O — CID 82979909

IUPAC3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol
SMILESCC(c1cccc(O)c1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C17H26N2O/c1-14(15-5-4-8-17(20)13-15)18-9-11-19(12-10-18)16-6-2-3-7-16/h4-5,8,13-14,16,20H,2-3,6-7,9-12H2,1H3
InChIKeyMAYNVUGLLOLQOM-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.01
Rot. Bonds3

About 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol

3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol (PubChem CID 82979909) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol.

Molecular Properties

Compound Name3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol
PubChem CID82979909
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol
SMILESCC(c1cccc(O)c1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C17H26N2O/c1-14(15-5-4-8-17(20)13-15)18-9-11-19(12-10-18)16-6-2-3-7-16/h4-5,8,13-14,16,20H,2-3,6-7,9-12H2,1H3
InChIKeyMAYNVUGLLOLQOM-UHFFFAOYSA-N
XLogP3.01
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 97201917
3-[1-(3-aminopyrrolidin-1-yl)ethyl]phenol
CID 62068559
2-[1-(3-chlorophenyl)ethyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79940142
4-bromo-2-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol
CID 82959216
1-[1-[4-(benzenesulfonyl)phenyl]ethyl]-4-cyclohexylpiperazine
CID 15392110
3-[1-[2-(aminomethyl)pyrrolidin-1-yl]ethyl]phenol
CID 115311592
6-[3-[4-[1-(4-cyclohexylpiperazin-1-yl)ethyl]phenyl]sulfinylphenoxy]hexan-1-ol
CID 178027169
2-chloropyrimidine;4-[1-(4-cyclohexylpiperazin-1-yl)ethyl]phenol;2-[4-[1-(4-cyclohexylpiperazin-1-yl)ethyl]phenoxy]pyrimidine
CID 162194222
2-[1-(3-fluorophenyl)ethyl]-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 78986500
4-[1-chloro-2-(4-cyclohexylpiperazin-1-yl)-2-phenylethyl]phenol
CID 71386889
2-(4-cyclopentylpiperazin-1-yl)-N-(2,6-dimethylphenyl)propanamide
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Frequently Asked Questions

What is the IUPAC name of 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol?
The IUPAC name of 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol (CID 82979909) is 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol.
What is the SMILES notation for 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol?
The canonical SMILES for 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol is CC(c1cccc(O)c1)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol?
The InChIKey is MAYNVUGLLOLQOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-14(15-5-4-8-17(20)13-15)18-9-11-19(12-10-18)16-6-2-3-7-16/h4-5,8,13-14,16,20H,2-3,6-7,9-12H2,1H3.
What are the key properties of 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol?
3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol has a molecular weight of 274.41 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(4-cyclopentylpiperazin-1-yl)ethyl]phenol is sourced from PubChem (CID 82979909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).