5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol

C15H24N2O2 — CID 107707305

IUPAC5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol
SMILESCC(NC1CCN(C)CC1C)c1cc(O)cc(O)c1
InChIInChI=1S/C15H24N2O2/c1-10-9-17(3)5-4-15(10)16-11(2)12-6-13(18)8-14(19)7-12/h6-8,10-11,15-16,18-19H,4-5,9H2,1-3H3
InChIKeyAAFSYQILWMIWRE-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.09
Rot. Bonds3

About 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol

5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol (PubChem CID 107707305) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol.

Molecular Properties

Compound Name5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol
PubChem CID107707305
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol
SMILESCC(NC1CCN(C)CC1C)c1cc(O)cc(O)c1
InChIInChI=1S/C15H24N2O2/c1-10-9-17(3)5-4-15(10)16-11(2)12-6-13(18)8-14(19)7-12/h6-8,10-11,15-16,18-19H,4-5,9H2,1-3H3
InChIKeyAAFSYQILWMIWRE-UHFFFAOYSA-N
XLogP2.09
TPSA55.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol 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

1,3-dimethyl-N-[1-(4-methylphenyl)ethyl]piperidin-4-amine
CID 115710203
N-[1-(3,4-difluorophenyl)ethyl]-1,3-dimethylpiperidin-4-amine
CID 115649937
(3R,4R)-1,3-dimethyl-N-[(1S)-1-phenylethyl]piperidin-4-amine
CID 11172331
2-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol
CID 107711309
2-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]-5-methoxyphenol
CID 104582308
2-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]-4-methoxyphenol
CID 104582309
N-[3-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]phenyl]acetamide
CID 115708260
1,3-dimethyl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 115706103
4-[2-[(1,3-dimethylpiperidin-4-yl)amino]propyl]phenol
CID 115717016
1,3-dimethyl-N-[1-(5-methylfuran-2-yl)ethyl]piperidin-4-amine
CID 115707104
N-[1-(2,5-dichlorophenyl)ethyl]-1,3-dimethylpiperidin-4-amine
CID 115714676
N-[1-(2,4-dibromophenyl)ethyl]-1,3-dimethylpiperidin-4-amine
CID 115717601

Frequently Asked Questions

What is the IUPAC name of 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol?
The IUPAC name of 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol (CID 107707305) is 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol.
What is the SMILES notation for 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol?
The canonical SMILES for 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol is CC(NC1CCN(C)CC1C)c1cc(O)cc(O)c1.
What is the InChIKey of 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol?
The InChIKey is AAFSYQILWMIWRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10-9-17(3)5-4-15(10)16-11(2)12-6-13(18)8-14(19)7-12/h6-8,10-11,15-16,18-19H,4-5,9H2,1-3H3.
What are the key properties of 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol?
5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol has a molecular weight of 264.37 g/mol, XLogP of 2.09, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]benzene-1,3-diol is sourced from PubChem (CID 107707305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).