(2-piperazin-1-yl-5-propan-2-ylphenyl)methanol

C14H22N2O — CID 138530373

IUPAC(2-piperazin-1-yl-5-propan-2-ylphenyl)methanol
SMILESCC(C)c1ccc(N2CCNCC2)c(CO)c1
InChIInChI=1S/C14H22N2O/c1-11(2)12-3-4-14(13(9-12)10-17)16-7-5-15-6-8-16/h3-4,9,11,15,17H,5-8,10H2,1-2H3
InChIKeyMVJNWYPJDUXLFT-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.71
Rot. Bonds3

About (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol

(2-piperazin-1-yl-5-propan-2-ylphenyl)methanol (PubChem CID 138530373) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol.

Molecular Properties

Compound Name(2-piperazin-1-yl-5-propan-2-ylphenyl)methanol
PubChem CID138530373
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(2-piperazin-1-yl-5-propan-2-ylphenyl)methanol
SMILESCC(C)c1ccc(N2CCNCC2)c(CO)c1
InChIInChI=1S/C14H22N2O/c1-11(2)12-3-4-14(13(9-12)10-17)16-7-5-15-6-8-16/h3-4,9,11,15,17H,5-8,10H2,1-2H3
InChIKeyMVJNWYPJDUXLFT-UHFFFAOYSA-N
XLogP1.71
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol?
The IUPAC name of (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol (CID 138530373) is (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol.
What is the SMILES notation for (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol?
The canonical SMILES for (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol is CC(C)c1ccc(N2CCNCC2)c(CO)c1.
What is the InChIKey of (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol?
The InChIKey is MVJNWYPJDUXLFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11(2)12-3-4-14(13(9-12)10-17)16-7-5-15-6-8-16/h3-4,9,11,15,17H,5-8,10H2,1-2H3.
What are the key properties of (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol?
(2-piperazin-1-yl-5-propan-2-ylphenyl)methanol has a molecular weight of 234.34 g/mol, XLogP of 1.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-piperazin-1-yl-5-propan-2-ylphenyl)methanol is sourced from PubChem (CID 138530373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).