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

C15H23NO3 — CID 82981208

IUPAC4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol
SMILESCOCC1CCN(Cc2cc(OC)ccc2O)CC1
InChIInChI=1S/C15H23NO3/c1-18-11-12-5-7-16(8-6-12)10-13-9-14(19-2)3-4-15(13)17/h3-4,9,12,17H,5-8,10-11H2,1-2H3
InChIKeyBQNDNAGIUILCDI-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.26
Rot. Bonds5

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

4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol (PubChem CID 82981208) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol.

Molecular Properties

Compound Name4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol
PubChem CID82981208
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol
SMILESCOCC1CCN(Cc2cc(OC)ccc2O)CC1
InChIInChI=1S/C15H23NO3/c1-18-11-12-5-7-16(8-6-12)10-13-9-14(19-2)3-4-15(13)17/h3-4,9,12,17H,5-8,10-11H2,1-2H3
InChIKeyBQNDNAGIUILCDI-UHFFFAOYSA-N
XLogP2.26
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(3-ethylpyrrolidin-1-yl)methyl]-4-methoxyphenol
CID 113351697
N-[[1-[(2-hydroxy-5-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide
CID 103917998
2-[[4-(1-aminoethyl)piperidin-1-yl]methyl]-4-methoxyphenol
CID 55217645
[4-methoxy-2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]phenyl]boronic acid
CID 65327539
4-methoxy-2-[(4-propylpiperazin-1-yl)methyl]phenol
CID 82975290
4-methoxy-2-(1,4,7-triazonan-1-ylmethyl)phenol
CID 165144364
2-[1-[(2-hydroxy-5-methoxyphenyl)methyl]piperidin-4-yl]oxyacetic acid
CID 65065719
4-methoxy-2-[[3-(methylaminomethyl)piperidin-1-yl]methyl]phenol
CID 61205073
1-[(2-hydroxy-4-methoxyphenyl)methyl]piperidin-4-ol
CID 2845869
2-[[4-[(4-bromophenyl)methyl]piperazin-1-yl]methyl]-4-methoxyphenol
CID 1371281
4-amino-2-[[3-(methoxymethyl)piperidin-1-yl]methyl]phenol
CID 106586086
2-[[3-(dimethylamino)piperidin-1-yl]methyl]-4-methoxyphenol
CID 82983035

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol?
The IUPAC name of 4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol (CID 82981208) is 4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol.
What is the SMILES notation for 4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol?
The canonical SMILES for 4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol is COCC1CCN(Cc2cc(OC)ccc2O)CC1.
What is the InChIKey of 4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol?
The InChIKey is BQNDNAGIUILCDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-18-11-12-5-7-16(8-6-12)10-13-9-14(19-2)3-4-15(13)17/h3-4,9,12,17H,5-8,10-11H2,1-2H3.
What are the key properties of 4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol?
4-methoxy-2-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol has a molecular weight of 265.35 g/mol, XLogP of 2.26, 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-(methoxymethyl)piperidin-1-yl]methyl]phenol is sourced from PubChem (CID 82981208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).