1-phenyl-2-piperazin-1-ylpropan-1-ol

C13H20N2O — CID 82264476

IUPAC1-phenyl-2-piperazin-1-ylpropan-1-ol
SMILESCC(C(O)c1ccccc1)N1CCNCC1
InChIInChI=1S/C13H20N2O/c1-11(15-9-7-14-8-10-15)13(16)12-5-3-2-4-6-12/h2-6,11,13-14,16H,7-10H2,1H3
InChIKeyMUSGQUVQKFOWQY-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.01
Rot. Bonds3

About 1-phenyl-2-piperazin-1-ylpropan-1-ol

1-phenyl-2-piperazin-1-ylpropan-1-ol (PubChem CID 82264476) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-phenyl-2-piperazin-1-ylpropan-1-ol.

Molecular Properties

Compound Name1-phenyl-2-piperazin-1-ylpropan-1-ol
PubChem CID82264476
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-phenyl-2-piperazin-1-ylpropan-1-ol
SMILESCC(C(O)c1ccccc1)N1CCNCC1
InChIInChI=1S/C13H20N2O/c1-11(15-9-7-14-8-10-15)13(16)12-5-3-2-4-6-12/h2-6,11,13-14,16H,7-10H2,1H3
InChIKeyMUSGQUVQKFOWQY-UHFFFAOYSA-N
XLogP1.01
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1-hydroxy-2-piperazin-1-ylpropyl)phenol
CID 82263328
(1R,2R)-1-phenyl-2-pyrrolidin-1-ylpropan-1-ol
CID 11830572
phenyl(piperazin-1-yl)methanol
CID 23037926
1-[(1S)-1-phenylethyl]piperazine;dihydrochloride
CID 57383523
1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine
CID 3030108
2-(4-methylsulfonylpiperazin-1-yl)-1-phenylpropan-1-ol
CID 62992614
(1S,2R)-2-[(5R,6S)-2,2,3,3,5,6-hexadeuterio-4-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]piperazin-1-yl]-1-phenylpropan-1-ol
CID 101102848
1-(1H-indol-3-yl)-2-piperazin-1-ylpropan-1-ol
CID 82264006
1-[bromo(phenyl)methyl]piperazine
CID 174618409
(E)-1-[4-(1-hydroxy-1-phenylpropan-2-yl)piperazin-1-yl]-3-phenylprop-2-en-1-one
CID 110184452
(1S,2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1-phenylpropan-1-ol
CID 46832946
1-(2-methoxynaphthalen-1-yl)-2-piperazin-1-ylpropan-1-ol
CID 82263008

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-piperazin-1-ylpropan-1-ol?
The IUPAC name of 1-phenyl-2-piperazin-1-ylpropan-1-ol (CID 82264476) is 1-phenyl-2-piperazin-1-ylpropan-1-ol.
What is the SMILES notation for 1-phenyl-2-piperazin-1-ylpropan-1-ol?
The canonical SMILES for 1-phenyl-2-piperazin-1-ylpropan-1-ol is CC(C(O)c1ccccc1)N1CCNCC1.
What is the InChIKey of 1-phenyl-2-piperazin-1-ylpropan-1-ol?
The InChIKey is MUSGQUVQKFOWQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-11(15-9-7-14-8-10-15)13(16)12-5-3-2-4-6-12/h2-6,11,13-14,16H,7-10H2,1H3.
What are the key properties of 1-phenyl-2-piperazin-1-ylpropan-1-ol?
1-phenyl-2-piperazin-1-ylpropan-1-ol has a molecular weight of 220.32 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-piperazin-1-ylpropan-1-ol is sourced from PubChem (CID 82264476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).