2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol

C19H25ClN2O2 — CID 17214027

IUPAC2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol
SMILESOCCNCCCNCc1ccccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C19H25ClN2O2/c20-18-8-6-16(7-9-18)15-24-19-5-2-1-4-17(19)14-22-11-3-10-21-12-13-23/h1-2,4-9,21-23H,3,10-15H2
InChIKeyBGACTYSMUGIFMO-UHFFFAOYSA-N
MW348.87 g/mol
LogP2.98
Rot. Bonds11

About 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol

2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol (PubChem CID 17214027) has the molecular formula C19H25ClN2O2 and a molecular weight of 348.87 g/mol. Its IUPAC name is 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol.

Molecular Properties

Compound Name2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol
PubChem CID17214027
Molecular FormulaC19H25ClN2O2
Molecular Weight348.87 g/mol
Exact Mass348.16
IUPAC Name2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol
SMILESOCCNCCCNCc1ccccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C19H25ClN2O2/c20-18-8-6-16(7-9-18)15-24-19-5-2-1-4-17(19)14-22-11-3-10-21-12-13-23/h1-2,4-9,21-23H,3,10-15H2
InChIKeyBGACTYSMUGIFMO-UHFFFAOYSA-N
XLogP2.98
TPSA53.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.87
LogP ≤ 52.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]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

2-[3-[(2-phenylmethoxyphenyl)methylamino]propylamino]ethanol
CID 17214025
2-[3-[(2-phenylmethoxyphenyl)methylamino]propylamino]ethanol;dihydrochloride
CID 17214024
N'-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]-N-methylpropane-1,3-diamine
CID 4720041
N-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]propan-1-amine
CID 4716575
2-(4-chlorophenyl)-N-[(2-phenylmethoxyphenyl)methyl]ethanamine;hydrochloride
CID 17208380
N-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]-1-phenylmethanamine
CID 4721375
N-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]-1-cyclopropylmethanamine
CID 57269923
N-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]-1-(2-methoxyphenyl)methanamine
CID 17207976
N-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]-2-(4-fluorophenyl)ethanamine;hydrochloride
CID 17292514
2-[2-[[(4-chlorophenyl)methylamino]methyl]phenoxy]ethanol
CID 111457786
2-[[3,4-bis[(4-chlorophenyl)methoxy]phenyl]methylamino]ethanol
CID 146309825
N-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]-1-(4-methylphenyl)methanamine;hydrochloride
CID 17332421

Frequently Asked Questions

What is the IUPAC name of 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol?
The IUPAC name of 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol (CID 17214027) is 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol.
What is the SMILES notation for 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol?
The canonical SMILES for 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol is OCCNCCCNCc1ccccc1OCc1ccc(Cl)cc1.
What is the InChIKey of 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol?
The InChIKey is BGACTYSMUGIFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25ClN2O2/c20-18-8-6-16(7-9-18)15-24-19-5-2-1-4-17(19)14-22-11-3-10-21-12-13-23/h1-2,4-9,21-23H,3,10-15H2.
What are the key properties of 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol?
2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol has a molecular weight of 348.87 g/mol, XLogP of 2.98, 11 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[[2-[(4-chlorophenyl)methoxy]phenyl]methylamino]propylamino]ethanol is sourced from PubChem (CID 17214027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).