2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol

C15H23NO3 — CID 55064076

IUPAC2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol
SMILESCOc1ccc(C(C)NC2CCCCC2O)c(O)c1
InChIInChI=1S/C15H23NO3/c1-10(16-13-5-3-4-6-14(13)17)12-8-7-11(19-2)9-15(12)18/h7-10,13-14,16-18H,3-6H2,1-2H3
InChIKeyGNAPIBAGIFMDJL-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.35
Rot. Bonds4

About 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol

2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol (PubChem CID 55064076) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol.

Molecular Properties

Compound Name2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol
PubChem CID55064076
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol
SMILESCOc1ccc(C(C)NC2CCCCC2O)c(O)c1
InChIInChI=1S/C15H23NO3/c1-10(16-13-5-3-4-6-14(13)17)12-8-7-11(19-2)9-15(12)18/h7-10,13-14,16-18H,3-6H2,1-2H3
InChIKeyGNAPIBAGIFMDJL-UHFFFAOYSA-N
XLogP2.35
TPSA61.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

Analyze 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol 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-[1-(cycloheptylamino)ethyl]-5-methoxyphenol
CID 43202473
2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol
CID 81371394
2-[1-[(2-hydroxycyclohexyl)methylamino]ethyl]-5-methoxyphenol
CID 64928670
2-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]-5-methoxyphenol
CID 104582308
2-[1-[(2,6-dimethylpiperidin-1-yl)amino]ethyl]-5-methoxyphenol
CID 83007109
5-methoxy-2-[1-[(2,2,3,3-tetramethylcyclopropyl)amino]ethyl]phenol
CID 79357914
5-methoxy-2-[1-[(1-propan-2-ylpiperidin-4-yl)amino]ethyl]phenol
CID 43206678
5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol
CID 103082952
2-hydroxy-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methoxybenzamide
CID 104956910
2-[1-[(2-hydroxycyclohexyl)methylamino]ethyl]-4-methoxyphenol
CID 64927300
5-[1-(2-hydroxy-4-methoxyphenyl)ethylamino]piperidin-2-one
CID 63663146
2-[1-(3,3-dimethylbutan-2-ylamino)ethyl]-5-methoxyphenol
CID 104582409

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol?
The IUPAC name of 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol (CID 55064076) is 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol.
What is the SMILES notation for 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol?
The canonical SMILES for 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol is COc1ccc(C(C)NC2CCCCC2O)c(O)c1.
What is the InChIKey of 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol?
The InChIKey is GNAPIBAGIFMDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-10(16-13-5-3-4-6-14(13)17)12-8-7-11(19-2)9-15(12)18/h7-10,13-14,16-18H,3-6H2,1-2H3.
What are the key properties of 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol?
2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol has a molecular weight of 265.35 g/mol, XLogP of 2.35, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol is sourced from PubChem (CID 55064076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).