2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol

C17H28N2O2 — CID 111434925

IUPAC2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol
SMILESCOc1ccc(C(CO)N(C)CCN2CCCCC2)cc1
InChIInChI=1S/C17H28N2O2/c1-18(12-13-19-10-4-3-5-11-19)17(14-20)15-6-8-16(21-2)9-7-15/h6-9,17,20H,3-5,10-14H2,1-2H3
InChIKeyVDQYZZSJJBRKQJ-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.15
Rot. Bonds7

About 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol

2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol (PubChem CID 111434925) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol
PubChem CID111434925
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol
SMILESCOc1ccc(C(CO)N(C)CCN2CCCCC2)cc1
InChIInChI=1S/C17H28N2O2/c1-18(12-13-19-10-4-3-5-11-19)17(14-20)15-6-8-16(21-2)9-7-15/h6-9,17,20H,3-5,10-14H2,1-2H3
InChIKeyVDQYZZSJJBRKQJ-UHFFFAOYSA-N
XLogP2.15
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl-methylamino]-2-(4-methoxyphenyl)ethanol
CID 100683475
1-(4-methoxyphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-one
CID 63207477
2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol
CID 111122510
1-(4-methoxyphenyl)-N'-methyl-N'-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 63206777
2-(azepan-1-yl)-1-(4-methoxyphenyl)ethanol
CID 54944635
2-[2-(benzenesulfinyl)ethyl-methylamino]-2-(4-methoxyphenyl)ethanol
CID 111122551
1-(4-chlorophenyl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 63206890
2-(3,4-dimethoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]acetic acid
CID 72853536
(2S)-2-(4-methoxy-2-methylphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]acetic acid
CID 97200558
2-(4-methoxyphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]ethanol
CID 111122596
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-ol
CID 115773280

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol?
The IUPAC name of 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol (CID 111434925) is 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol.
What is the SMILES notation for 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol?
The canonical SMILES for 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol is COc1ccc(C(CO)N(C)CCN2CCCCC2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol?
The InChIKey is VDQYZZSJJBRKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-18(12-13-19-10-4-3-5-11-19)17(14-20)15-6-8-16(21-2)9-7-15/h6-9,17,20H,3-5,10-14H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol?
2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol has a molecular weight of 292.42 g/mol, XLogP of 2.15, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol is sourced from PubChem (CID 111434925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).