4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol

C15H24N2O2 — CID 82975290

IUPAC4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol
SMILESCCCN1CCN(Cc2cc(OC)ccc2O)CC1
InChIInChI=1S/C15H24N2O2/c1-3-6-16-7-9-17(10-8-16)12-13-11-14(19-2)4-5-15(13)18/h4-5,11,18H,3,6-10,12H2,1-2H3
InChIKeyWPJXIMUTLXPLGA-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.93
Rot. Bonds5

About 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol

4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol (PubChem CID 82975290) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol.

Molecular Properties

Compound Name4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol
PubChem CID82975290
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol
SMILESCCCN1CCN(Cc2cc(OC)ccc2O)CC1
InChIInChI=1S/C15H24N2O2/c1-3-6-16-7-9-17(10-8-16)12-13-11-14(19-2)4-5-15(13)18/h4-5,11,18H,3,6-10,12H2,1-2H3
InChIKeyWPJXIMUTLXPLGA-UHFFFAOYSA-N
XLogP1.93
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

Analyze 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methoxy-2-(1,4,7-triazonan-1-ylmethyl)phenol
CID 165144364
2-[[4-[(4-bromophenyl)methyl]piperazin-1-yl]methyl]-4-methoxyphenol
CID 1371281
2-[4-[(2-hydroxy-5-methoxyphenyl)methyl]-1,4-diazepan-1-yl]acetic acid
CID 65061405
2-[(3,4-dimethylpiperazin-1-yl)methyl]-4-methoxyphenol
CID 82980053
2-[[4-(1-aminoethyl)piperidin-1-yl]methyl]-4-methoxyphenol
CID 55217645
4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol
CID 82981208
2-[(3-ethylpyrrolidin-1-yl)methyl]-4-methoxyphenol
CID 113351697
(2-hydroxy-5-methoxyphenyl)-(4-propylpiperazin-1-yl)methanone
CID 60712175
4-methoxy-2-[[4-(3-phenylprop-2-enyl)piperazin-1-yl]methyl]phenol
CID 782278
4-[(3S,4S)-4-(4-methoxyphenyl)hexan-3-yl]-2-[(4-methylpiperazin-1-yl)methyl]phenol
CID 92573788
2-[[4-[5-(diethylamino)-2-pyridinyl]piperazin-1-yl]methyl]-4-methoxyphenol
CID 54133541
2-[1-[(2-hydroxy-5-methoxyphenyl)methyl]piperidin-4-yl]oxyacetic acid
CID 65065719

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol?
The IUPAC name of 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol (CID 82975290) is 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol.
What is the SMILES notation for 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol?
The canonical SMILES for 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol is CCCN1CCN(Cc2cc(OC)ccc2O)CC1.
What is the InChIKey of 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol?
The InChIKey is WPJXIMUTLXPLGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-6-16-7-9-17(10-8-16)12-13-11-14(19-2)4-5-15(13)18/h4-5,11,18H,3,6-10,12H2,1-2H3.
What are the key properties of 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol?
4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol has a molecular weight of 264.37 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol is sourced from PubChem (CID 82975290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).