7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol

C22H24N2O2 — CID 2672003

IUPAC7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol
SMILESCOc1ccc2ccc(O)c(CN3CCN(c4ccccc4)CC3)c2c1
InChIInChI=1S/C22H24N2O2/c1-26-19-9-7-17-8-10-22(25)21(20(17)15-19)16-23-11-13-24(14-12-23)18-5-3-2-4-6-18/h2-10,15,25H,11-14,16H2,1H3
InChIKeyONSSVDAUOPJQLJ-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.88
Rot. Bonds4

About 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol

7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol (PubChem CID 2672003) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol.

Molecular Properties

Compound Name7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol
PubChem CID2672003
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol
SMILESCOc1ccc2ccc(O)c(CN3CCN(c4ccccc4)CC3)c2c1
InChIInChI=1S/C22H24N2O2/c1-26-19-9-7-17-8-10-22(25)21(20(17)15-19)16-23-11-13-24(14-12-23)18-5-3-2-4-6-18/h2-10,15,25H,11-14,16H2,1H3
InChIKeyONSSVDAUOPJQLJ-UHFFFAOYSA-N
XLogP3.88
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol 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

7-methoxy-1-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]naphthalen-2-ol
CID 2672032
1-[4-[(2-hydroxy-7-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]ethanone
CID 75412809
1-[[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methyl]naphthalen-2-ol
CID 9325307
7-methoxy-1-[[(2S)-2-phenylazetidin-1-yl]methyl]naphthalen-2-ol
CID 95150098
1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-7-methoxynaphthalen-2-ol
CID 26031863
1-[[(2S)-2-ethylmorpholin-4-yl]methyl]-7-methoxynaphthalen-2-ol
CID 34894357
1-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]naphthalen-2-ol
CID 2845612
1-[(2-hydroxy-7-methoxynaphthalen-1-yl)methyl]-N-pyridin-2-ylpiperidine-4-carboxamide
CID 55865729
1-[(2S)-2-(6-methoxynaphthalen-2-yl)propyl]-4-phenylpiperazine
CID 92967649
6-methoxy-3-(4-methoxyphenyl)-2-[(4-phenylpiperazin-1-yl)methyl]-1H-indole
CID 132543340
3-(2-bromophenoxy)-7-hydroxy-8-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]chromen-4-one
CID 95399499
2,6-dimethoxy-4-[(4-phenylpiperazin-1-yl)methyl]phenol
CID 791376

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol?
The IUPAC name of 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol (CID 2672003) is 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol.
What is the SMILES notation for 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol?
The canonical SMILES for 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol is COc1ccc2ccc(O)c(CN3CCN(c4ccccc4)CC3)c2c1.
What is the InChIKey of 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol?
The InChIKey is ONSSVDAUOPJQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-26-19-9-7-17-8-10-22(25)21(20(17)15-19)16-23-11-13-24(14-12-23)18-5-3-2-4-6-18/h2-10,15,25H,11-14,16H2,1H3.
What are the key properties of 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol?
7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol has a molecular weight of 348.45 g/mol, XLogP of 3.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1-[(4-phenylpiperazin-1-yl)methyl]naphthalen-2-ol is sourced from PubChem (CID 2672003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).