2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol

C15H23NO2 — CID 81371394

IUPAC2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol
SMILESCOc1ccc([C@@H](C)NC2CCCCC2O)cc1
InChIInChI=1S/C15H23NO2/c1-11(12-7-9-13(18-2)10-8-12)16-14-5-3-4-6-15(14)17/h7-11,14-17H,3-6H2,1-2H3/t11-,14?,15?/m1/s1
InChIKeyIGCUAASSHDIHNH-VCANKDNSSA-N
MW249.35 g/mol
LogP2.65
Rot. Bonds4

About 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol

2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol (PubChem CID 81371394) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol
PubChem CID81371394
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol
SMILESCOc1ccc([C@@H](C)NC2CCCCC2O)cc1
InChIInChI=1S/C15H23NO2/c1-11(12-7-9-13(18-2)10-8-12)16-14-5-3-4-6-15(14)17/h7-11,14-17H,3-6H2,1-2H3/t11-,14?,15?/m1/s1
InChIKeyIGCUAASSHDIHNH-VCANKDNSSA-N
XLogP2.65
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol 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-[[(1R)-1-(4-chlorophenyl)ethyl]amino]cyclohexan-1-ol
CID 81352447
2-methoxy-N-[1-(4-methoxyphenyl)ethyl]cyclopentan-1-amine
CID 62086759
cis-(1S,2R)-1-N-[(1S)-1-(4-methoxyphenyl)ethyl]cyclopentane-1,2-diamine
CID 124745453
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]cycloheptan-1-ol
CID 81352634
N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine
CID 43189950
2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol
CID 55064076
2-[1-(4-iodophenyl)ethylamino]cyclopentan-1-ol
CID 115891348
2-[1-[4-(trifluoromethyl)phenyl]ethylamino]cyclohexan-1-ol
CID 62366668
trans-(1R,2R)-2-[[(1R)-1-phenylethyl]amino]cyclopentan-1-ol
CID 10171980
trans-(1R,2R)-2-[[(1S)-1-phenylethyl]amino]cyclopentan-1-ol
CID 10035860
2-(1-pyridin-4-ylethylamino)cyclopentan-1-ol
CID 60713516
trans-(1R,2R)-2-(1-pyridin-4-ylethylamino)cyclopentan-1-ol
CID 102733108

Frequently Asked Questions

What is the IUPAC name of 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol?
The IUPAC name of 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol (CID 81371394) is 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol?
The canonical SMILES for 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol is COc1ccc([C@@H](C)NC2CCCCC2O)cc1.
What is the InChIKey of 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol?
The InChIKey is IGCUAASSHDIHNH-VCANKDNSSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11(12-7-9-13(18-2)10-8-12)16-14-5-3-4-6-15(14)17/h7-11,14-17H,3-6H2,1-2H3/t11-,14?,15?/m1/s1.
What are the key properties of 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol?
2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol has a molecular weight of 249.35 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol is sourced from PubChem (CID 81371394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).