4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol

C16H26N2O — CID 63636728

IUPAC4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol
SMILESCCCN(C1CCCNC1)C(C)c1ccc(O)cc1
InChIInChI=1S/C16H26N2O/c1-3-11-18(15-5-4-10-17-12-15)13(2)14-6-8-16(19)9-7-14/h6-9,13,15,17,19H,3-5,10-12H2,1-2H3
InChIKeyOGLLARVFUFUDCF-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.92
Rot. Bonds5

About 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol

4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol (PubChem CID 63636728) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol.

Molecular Properties

Compound Name4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol
PubChem CID63636728
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol
SMILESCCCN(C1CCCNC1)C(C)c1ccc(O)cc1
InChIInChI=1S/C16H26N2O/c1-3-11-18(15-5-4-10-17-12-15)13(2)14-6-8-16(19)9-7-14/h6-9,13,15,17,19H,3-5,10-12H2,1-2H3
InChIKeyOGLLARVFUFUDCF-UHFFFAOYSA-N
XLogP2.92
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol 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

N-[1-[4-(dimethylamino)phenyl]ethyl]-N-propylpiperidin-3-amine
CID 63638109
N-[1-(4-chlorophenyl)ethyl]-N-propylpyrrolidin-3-amine
CID 63300570
4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol
CID 63643806
N-ethyl-N-[1-(4-ethylphenyl)ethyl]piperidin-3-amine
CID 63644319
N-[1-(3-methoxyphenyl)ethyl]-N-propylpiperidin-3-amine
CID 63637072
5-fluoro-2-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol
CID 63636382
N-ethyl-N-(1-phenylethyl)piperidin-3-amine
CID 63643629
N-[1-(4-propoxyphenyl)ethyl]-N-propylpyrrolidin-3-amine
CID 63300783
N-[1-(2-bromophenyl)ethyl]-N-propylpiperidin-3-amine
CID 63637762
N-[1-(2,5-dichlorophenyl)ethyl]-N-propylpiperidin-3-amine
CID 63636723
N-[1-(3-bromo-4-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine
CID 55205536
N-(1-phenylpropyl)-N-propylpiperidin-3-amine
CID 63638122

Frequently Asked Questions

What is the IUPAC name of 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol?
The IUPAC name of 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol (CID 63636728) is 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol.
What is the SMILES notation for 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol?
The canonical SMILES for 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol is CCCN(C1CCCNC1)C(C)c1ccc(O)cc1.
What is the InChIKey of 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol?
The InChIKey is OGLLARVFUFUDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-11-18(15-5-4-10-17-12-15)13(2)14-6-8-16(19)9-7-14/h6-9,13,15,17,19H,3-5,10-12H2,1-2H3.
What are the key properties of 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol?
4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol has a molecular weight of 262.40 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol is sourced from PubChem (CID 63636728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).