2-piperazin-1-yl-6-piperidin-4-ylphenol

C15H23N3O — CID 165349860

IUPAC2-piperazin-1-yl-6-piperidin-4-ylphenol
SMILESOc1c(C2CCNCC2)cccc1N1CCNCC1
InChIInChI=1S/C15H23N3O/c19-15-13(12-4-6-16-7-5-12)2-1-3-14(15)18-10-8-17-9-11-18/h1-3,12,16-17,19H,4-11H2
InChIKeyMKFZFTIURVYOFK-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.27
Rot. Bonds2

About 2-piperazin-1-yl-6-piperidin-4-ylphenol

2-piperazin-1-yl-6-piperidin-4-ylphenol (PubChem CID 165349860) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-piperazin-1-yl-6-piperidin-4-ylphenol.

Molecular Properties

Compound Name2-piperazin-1-yl-6-piperidin-4-ylphenol
PubChem CID165349860
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-piperazin-1-yl-6-piperidin-4-ylphenol
SMILESOc1c(C2CCNCC2)cccc1N1CCNCC1
InChIInChI=1S/C15H23N3O/c19-15-13(12-4-6-16-7-5-12)2-1-3-14(15)18-10-8-17-9-11-18/h1-3,12,16-17,19H,4-11H2
InChIKeyMKFZFTIURVYOFK-UHFFFAOYSA-N
XLogP1.27
TPSA47.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-6-piperidin-4-ylphenol
CID 82623407
2-chloro-6-piperazin-1-ylphenol
CID 131297949
2-cyclopropyl-6-piperazin-1-ylbenzonitrile
CID 176886645
3-chloro-6-piperidin-4-ylbenzene-1,2-diol
CID 117327816
2-amino-3-piperidin-4-ylphenol
CID 117103764
1-(2-piperazin-1-ylphenyl)piperazine;hydrobromide
CID 118703673
4-cyclopropyl-3-piperazin-1-ylbenzonitrile
CID 171630505
2,6-di(cyclobutyl)phenol
CID 57426118
2-methyl-8-piperidin-4-yl-3,4-dihydro-1H-isoquinoline
CID 58777938
1-(2-chlorophenyl)piperazine
CID 162116490
2-piperazin-1-ylbenzoyl bromide
CID 141087423
2-methylsulfanyl-6-[(3S)-pyrrolidin-3-yl]phenol
CID 131145885

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-6-piperidin-4-ylphenol?
The IUPAC name of 2-piperazin-1-yl-6-piperidin-4-ylphenol (CID 165349860) is 2-piperazin-1-yl-6-piperidin-4-ylphenol.
What is the SMILES notation for 2-piperazin-1-yl-6-piperidin-4-ylphenol?
The canonical SMILES for 2-piperazin-1-yl-6-piperidin-4-ylphenol is Oc1c(C2CCNCC2)cccc1N1CCNCC1.
What is the InChIKey of 2-piperazin-1-yl-6-piperidin-4-ylphenol?
The InChIKey is MKFZFTIURVYOFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c19-15-13(12-4-6-16-7-5-12)2-1-3-14(15)18-10-8-17-9-11-18/h1-3,12,16-17,19H,4-11H2.
What are the key properties of 2-piperazin-1-yl-6-piperidin-4-ylphenol?
2-piperazin-1-yl-6-piperidin-4-ylphenol has a molecular weight of 261.37 g/mol, XLogP of 1.27, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-6-piperidin-4-ylphenol is sourced from PubChem (CID 165349860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).