1,2-diphenylpiperazine;propan-1-ol

C19H26N2O — CID 174486026

IUPAC1,2-diphenylpiperazine;propan-1-ol
SMILESCCCO.c1ccc(C2CNCCN2c2ccccc2)cc1
InChIInChI=1S/C16H18N2.C3H8O/c1-3-7-14(8-4-1)16-13-17-11-12-18(16)15-9-5-2-6-10-15;1-2-3-4/h1-10,16-17H,11-13H2;4H,2-3H2,1H3
InChIKeyCCWHLHWIVIHAAV-UHFFFAOYSA-N
MW298.43 g/mol
LogP3.23
Rot. Bonds3

About 1,2-diphenylpiperazine;propan-1-ol

1,2-diphenylpiperazine;propan-1-ol (PubChem CID 174486026) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is 1,2-diphenylpiperazine;propan-1-ol.

Molecular Properties

Compound Name1,2-diphenylpiperazine;propan-1-ol
PubChem CID174486026
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC Name1,2-diphenylpiperazine;propan-1-ol
SMILESCCCO.c1ccc(C2CNCCN2c2ccccc2)cc1
InChIInChI=1S/C16H18N2.C3H8O/c1-3-7-14(8-4-1)16-13-17-11-12-18(16)15-9-5-2-6-10-15;1-2-3-4/h1-10,16-17H,11-13H2;4H,2-3H2,1H3
InChIKeyCCWHLHWIVIHAAV-UHFFFAOYSA-N
XLogP3.23
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(1-phenylpiperazin-2-yl)phenyl]ethanone
CID 175135237
1-(4-chlorophenyl)-2-phenylpiperazine
CID 64939172
4-(1-phenylpiperazin-2-yl)benzonitrile
CID 54309593
1-phenyl-2-propylpiperazine
CID 70549920
[(2R)-1-phenylpiperazin-2-yl]methanol
CID 139491913
1-(3,4-dichlorophenyl)-2-phenylpiperazine
CID 64939175
1,2-diphenylpyrrolidine;ethanol
CID 67627522
2-(2-phenylpiperazin-1-yl)pyrimidine
CID 54474216
1-(2-phenylpiperazin-1-yl)propan-1-one
CID 73440047
2-ethyl-1-(2-phenylpiperazin-1-yl)butan-1-one
CID 82246038
1-(2,6-dibromophenyl)-2-phenylpiperazine
CID 107603813
(7S)-7-(4-fluorophenyl)-1-phenyl-1,4-diazepane
CID 124565935

Frequently Asked Questions

What is the IUPAC name of 1,2-diphenylpiperazine;propan-1-ol?
The IUPAC name of 1,2-diphenylpiperazine;propan-1-ol (CID 174486026) is 1,2-diphenylpiperazine;propan-1-ol.
What is the SMILES notation for 1,2-diphenylpiperazine;propan-1-ol?
The canonical SMILES for 1,2-diphenylpiperazine;propan-1-ol is CCCO.c1ccc(C2CNCCN2c2ccccc2)cc1.
What is the InChIKey of 1,2-diphenylpiperazine;propan-1-ol?
The InChIKey is CCWHLHWIVIHAAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2.C3H8O/c1-3-7-14(8-4-1)16-13-17-11-12-18(16)15-9-5-2-6-10-15;1-2-3-4/h1-10,16-17H,11-13H2;4H,2-3H2,1H3.
What are the key properties of 1,2-diphenylpiperazine;propan-1-ol?
1,2-diphenylpiperazine;propan-1-ol has a molecular weight of 298.43 g/mol, XLogP of 3.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenylpiperazine;propan-1-ol is sourced from PubChem (CID 174486026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).