1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol

C15H24N2O2 — CID 106835457

IUPAC1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol
SMILESCOc1ccc(N)cc1CN1CCC(C(C)O)CC1
InChIInChI=1S/C15H24N2O2/c1-11(18)12-5-7-17(8-6-12)10-13-9-14(16)3-4-15(13)19-2/h3-4,9,11-12,18H,5-8,10,16H2,1-2H3
InChIKeyQFYLFHRFSLHUSA-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.87
Rot. Bonds4

About 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol

1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol (PubChem CID 106835457) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol
PubChem CID106835457
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol
SMILESCOc1ccc(N)cc1CN1CCC(C(C)O)CC1
InChIInChI=1S/C15H24N2O2/c1-11(18)12-5-7-17(8-6-12)10-13-9-14(16)3-4-15(13)19-2/h3-4,9,11-12,18H,5-8,10,16H2,1-2H3
InChIKeyQFYLFHRFSLHUSA-UHFFFAOYSA-N
XLogP1.87
TPSA58.72 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 ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol 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

[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]methanol
CID 43134614
3-[[4-(1-hydroxyethyl)piperidin-1-yl]methyl]-4-methoxybenzenecarbothioamide
CID 106836011
1-[1-[[4-(aminomethyl)-3-methoxyphenyl]methyl]piperidin-4-yl]ethanol
CID 106835613
1-[1-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-yl]ethanamine;hydrochloride
CID 119920705
3-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)-4-methoxyaniline
CID 43620120
1-[1-[(2-amino-5-fluorophenyl)methyl]piperidin-4-yl]ethanol
CID 106835532
3-[(3-ethylpiperidin-1-yl)methyl]-4-methoxyaniline
CID 43584169
1-[4-methoxy-3-[(4-propan-2-ylpiperidin-1-yl)methyl]phenyl]ethanone
CID 103714072
3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]-4-methoxyaniline
CID 43581167
4-methoxy-3-[(3-methylpiperidin-1-yl)methyl]aniline
CID 43134589
[(2R)-1-[(5-amino-2-methoxyphenyl)methyl]pyrrolidin-2-yl]methanol
CID 70140500
1-[1-[(2-chloro-4-methoxyphenyl)methyl]piperidin-4-yl]ethanol
CID 111824353

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol?
The IUPAC name of 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol (CID 106835457) is 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol.
What is the SMILES notation for 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol?
The canonical SMILES for 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol is COc1ccc(N)cc1CN1CCC(C(C)O)CC1.
What is the InChIKey of 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol?
The InChIKey is QFYLFHRFSLHUSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(18)12-5-7-17(8-6-12)10-13-9-14(16)3-4-15(13)19-2/h3-4,9,11-12,18H,5-8,10,16H2,1-2H3.
What are the key properties of 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol?
1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol has a molecular weight of 264.37 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]ethanol is sourced from PubChem (CID 106835457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).