O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine

C15H24N2O3 — CID 117450339

IUPACO-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine
SMILESCOc1cc(CCON)ccc1OC1CCCN(C)C1
InChIInChI=1S/C15H24N2O3/c1-17-8-3-4-13(11-17)20-14-6-5-12(7-9-19-16)10-15(14)18-2/h5-6,10,13H,3-4,7-9,11,16H2,1-2H3
InChIKeyJJWLPLRHQNFXDE-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.60
Rot. Bonds6

About O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine

O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine (PubChem CID 117450339) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine.

Molecular Properties

Compound NameO-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine
PubChem CID117450339
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameO-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine
SMILESCOc1cc(CCON)ccc1OC1CCCN(C)C1
InChIInChI=1S/C15H24N2O3/c1-17-8-3-4-13(11-17)20-14-6-5-12(7-9-19-16)10-15(14)18-2/h5-6,10,13H,3-4,7-9,11,16H2,1-2H3
InChIKeyJJWLPLRHQNFXDE-UHFFFAOYSA-N
XLogP1.60
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine 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

3-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]propanal
CID 117444677
O-[2-[4-methoxy-3-(1-methylazetidin-3-yl)oxyphenyl]ethyl]hydroxylamine
CID 117384188
3-[4-methoxy-3-(1-methylpiperidin-3-yl)oxyphenyl]propan-1-ol
CID 117448362
3-[4-methoxy-3-(1-methylpiperidin-3-yl)oxyphenyl]propanoic acid
CID 117473467
O-[2-[4-methoxy-3-(thian-3-yloxy)phenyl]ethyl]hydroxylamine
CID 117455774
O-[[3-methoxy-4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]hydroxylamine
CID 117420170
4-[3-methoxy-4-(1-methylpyrrolidin-3-yl)oxyphenyl]butanoic acid
CID 117473451
O-[2-(4-methoxy-3-piperidin-3-yloxyphenyl)ethyl]hydroxylamine
CID 117420163
1-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]cyclopropan-1-ol
CID 117444399
2-[[3-methoxy-4-(1-methylpyrrolidin-3-yl)oxyphenyl]methyl]piperidine
CID 117489930
3-amino-3-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]propanoic acid
CID 117493373
2-[3-methoxy-4-(1-methylpyrrolidin-3-yl)oxyphenyl]propan-2-amine
CID 117415768

Frequently Asked Questions

What is the IUPAC name of O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine?
The IUPAC name of O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine (CID 117450339) is O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine.
What is the SMILES notation for O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine?
The canonical SMILES for O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine is COc1cc(CCON)ccc1OC1CCCN(C)C1.
What is the InChIKey of O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine?
The InChIKey is JJWLPLRHQNFXDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-17-8-3-4-13(11-17)20-14-6-5-12(7-9-19-16)10-15(14)18-2/h5-6,10,13H,3-4,7-9,11,16H2,1-2H3.
What are the key properties of O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine?
O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine has a molecular weight of 280.37 g/mol, XLogP of 1.60, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-[3-methoxy-4-(1-methylpiperidin-3-yl)oxyphenyl]ethyl]hydroxylamine is sourced from PubChem (CID 117450339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).