[2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol

C17H21N3O — CID 10221435

IUPAC[2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol
SMILESCN1CCN(c2ncccc2CO)C(c2ccccc2)C1
InChIInChI=1S/C17H21N3O/c1-19-10-11-20(17-15(13-21)8-5-9-18-17)16(12-19)14-6-3-2-4-7-14/h2-9,16,21H,10-13H2,1H3
InChIKeyPYZPABZGIRHQTA-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.07
Rot. Bonds3

About [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol

[2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol (PubChem CID 10221435) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol
PubChem CID10221435
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name[2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol
SMILESCN1CCN(c2ncccc2CO)C(c2ccccc2)C1
InChIInChI=1S/C17H21N3O/c1-19-10-11-20(17-15(13-21)8-5-9-18-17)16(12-19)14-6-3-2-4-7-14/h2-9,16,21H,10-13H2,1H3
InChIKeyPYZPABZGIRHQTA-UHFFFAOYSA-N
XLogP2.07
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol?
The IUPAC name of [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol (CID 10221435) is [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol?
The canonical SMILES for [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol is CN1CCN(c2ncccc2CO)C(c2ccccc2)C1.
What is the InChIKey of [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol?
The InChIKey is PYZPABZGIRHQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-19-10-11-20(17-15(13-21)8-5-9-18-17)16(12-19)14-6-3-2-4-7-14/h2-9,16,21H,10-13H2,1H3.
What are the key properties of [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol?
[2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol has a molecular weight of 283.38 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 10221435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).