3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol

C13H26N2O — CID 79643371

IUPAC3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol
SMILESCCC(C)N1CCN(C2CCC(O)C2)CC1
InChIInChI=1S/C13H26N2O/c1-3-11(2)14-6-8-15(9-7-14)12-4-5-13(16)10-12/h11-13,16H,3-10H2,1-2H3
InChIKeyBJYFSBRAFCWFJD-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.32
Rot. Bonds3

About 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol

3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol (PubChem CID 79643371) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol
PubChem CID79643371
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol
SMILESCCC(C)N1CCN(C2CCC(O)C2)CC1
InChIInChI=1S/C13H26N2O/c1-3-11(2)14-6-8-15(9-7-14)12-4-5-13(16)10-12/h11-13,16H,3-10H2,1-2H3
InChIKeyBJYFSBRAFCWFJD-UHFFFAOYSA-N
XLogP1.32
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-cyclopropylpiperazin-1-yl)cyclopentan-1-ol
CID 79643255
1-butan-2-yl-4-cyclohexylpiperazine;oxalic acid
CID 17369821
trans-(1S,2S)-2-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol
CID 102734676
trans-(1R,2R)-2-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol
CID 102734677
4-(4-cyclopropylpiperazin-1-yl)pentan-2-amine
CID 64706994
1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine
CID 170586069
[1-amino-3-(4-butan-2-ylpiperazin-1-yl)cyclohexyl]methanol
CID 79634360
1-butan-2-yl-4-(difluoromethyl)piperidine
CID 127988916
3-piperazin-1-ylcyclopentan-1-ol
CID 84653883
1-butan-2-yl-4-cyclobutylsulfonylpiperazine
CID 130440353
[3-(4-butan-2-ylpiperazin-1-yl)-1-(propylamino)cyclopentyl]methanol
CID 79646989
1-amino-3-(4-butan-2-ylpiperazin-1-yl)cyclohexane-1-carboxylic acid
CID 79642243

Frequently Asked Questions

What is the IUPAC name of 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol?
The IUPAC name of 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol (CID 79643371) is 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol.
What is the SMILES notation for 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol?
The canonical SMILES for 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol is CCC(C)N1CCN(C2CCC(O)C2)CC1.
What is the InChIKey of 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol?
The InChIKey is BJYFSBRAFCWFJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-3-11(2)14-6-8-15(9-7-14)12-4-5-13(16)10-12/h11-13,16H,3-10H2,1-2H3.
What are the key properties of 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol?
3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol has a molecular weight of 226.36 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol is sourced from PubChem (CID 79643371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).