2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol

C15H24N2O2 — CID 83007608

IUPAC2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol
SMILESCOc1ccc(O)c(CNN2C(C)CCCC2C)c1
InChIInChI=1S/C15H24N2O2/c1-11-5-4-6-12(2)17(11)16-10-13-9-14(19-3)7-8-15(13)18/h7-9,11-12,16,18H,4-6,10H2,1-3H3
InChIKeyDKXZMFFFTPSNRZ-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.67
Rot. Bonds4

About 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol

2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol (PubChem CID 83007608) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol.

Molecular Properties

Compound Name2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol
PubChem CID83007608
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol
SMILESCOc1ccc(O)c(CNN2C(C)CCCC2C)c1
InChIInChI=1S/C15H24N2O2/c1-11-5-4-6-12(2)17(11)16-10-13-9-14(19-3)7-8-15(13)18/h7-9,11-12,16,18H,4-6,10H2,1-3H3
InChIKeyDKXZMFFFTPSNRZ-UHFFFAOYSA-N
XLogP2.67
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(2,5-dimethoxyphenyl)methyl]-2,6-dimethylpiperidin-1-amine
CID 83010248
N-(2,6-dimethylpiperidin-1-yl)-2-hydroxy-5-methoxybenzamide
CID 115279910
2-[1-[(2,6-dimethylpiperidin-1-yl)amino]ethyl]-5-methoxyphenol
CID 83007109
2-[[(1-ethylpiperidin-4-yl)amino]methyl]-4-methoxyphenol
CID 54917281
4-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-2,6-dimethoxyphenol
CID 83009315
2-[(cyclopentyloxyamino)methyl]-4-methoxyphenol
CID 83229458
4-methoxy-2-[[(3-methylcyclopentyl)methylamino]methyl]phenol
CID 107411546
4-methoxy-2-[(2-methylazepan-1-yl)methyl]phenol
CID 82980507
4-methoxy-2-[[(1-propan-2-ylpiperidin-4-yl)amino]methyl]phenol
CID 28717433
N-[2-(4-methoxyphenoxy)ethyl]-2,6-dimethylpiperidin-1-amine
CID 83021772
2-chloro-4-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]phenol
CID 83006911
2-[(1,2,3,5,6,7,8,8a-octahydroindolizin-1-ylamino)methyl]-4-methoxyphenol
CID 43694220

Frequently Asked Questions

What is the IUPAC name of 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol?
The IUPAC name of 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol (CID 83007608) is 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol.
What is the SMILES notation for 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol?
The canonical SMILES for 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol is COc1ccc(O)c(CNN2C(C)CCCC2C)c1.
What is the InChIKey of 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol?
The InChIKey is DKXZMFFFTPSNRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11-5-4-6-12(2)17(11)16-10-13-9-14(19-3)7-8-15(13)18/h7-9,11-12,16,18H,4-6,10H2,1-3H3.
What are the key properties of 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol?
2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol has a molecular weight of 264.37 g/mol, XLogP of 2.67, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol is sourced from PubChem (CID 83007608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).