2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol

C15H23NO3 — CID 110922411

IUPAC2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol
SMILESCOc1cc(OC)cc(C(O)CNC2CCCC2)c1
InChIInChI=1S/C15H23NO3/c1-18-13-7-11(8-14(9-13)19-2)15(17)10-16-12-5-3-4-6-12/h7-9,12,15-17H,3-6,10H2,1-2H3
InChIKeyLLZBSZONZMBGND-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.27
Rot. Bonds6

About 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol

2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol (PubChem CID 110922411) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol.

Molecular Properties

Compound Name2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol
PubChem CID110922411
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol
SMILESCOc1cc(OC)cc(C(O)CNC2CCCC2)c1
InChIInChI=1S/C15H23NO3/c1-18-13-7-11(8-14(9-13)19-2)15(17)10-16-12-5-3-4-6-12/h7-9,12,15-17H,3-6,10H2,1-2H3
InChIKeyLLZBSZONZMBGND-UHFFFAOYSA-N
XLogP2.27
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)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-(cyclobutylamino)-1-(4-methoxyphenyl)ethanol
CID 62414370
2-(cyclopentylamino)-1-(2,4-dimethoxyphenyl)ethanol
CID 112501830
(1R)-2-[[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]amino]-1-(3,5-dimethoxyphenyl)ethanol
CID 98855938
(1R)-2-[[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]amino]-1-(3,5-dimethoxyphenyl)ethanol
CID 98855935
2-(2-bicyclo[2.2.1]heptanylamino)-1-(3,5-dimethoxyphenyl)ethanol
CID 75440752
1-(3,5-dimethoxyphenyl)-2-(propan-2-ylamino)ethanol;hydrochloride
CID 157085885
2-(cyclohexylamino)-1-(3-propan-2-yloxyphenyl)ethanol
CID 110922419
1-(4-methoxyphenyl)-2-(thian-4-ylamino)ethanol
CID 71941895
(1S)-2-(cycloheptylamino)-1-(4-methylphenyl)ethanol
CID 39350104
2-(cycloheptylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 60900441
2-(cyclopent-3-en-1-ylamino)-1-(3-methoxyphenyl)ethanol
CID 113475226
2-[(4-ethylcyclohexyl)amino]-1-(4-methoxyphenyl)ethanol
CID 60760718

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol?
The IUPAC name of 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol (CID 110922411) is 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol.
What is the SMILES notation for 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol?
The canonical SMILES for 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol is COc1cc(OC)cc(C(O)CNC2CCCC2)c1.
What is the InChIKey of 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol?
The InChIKey is LLZBSZONZMBGND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-18-13-7-11(8-14(9-13)19-2)15(17)10-16-12-5-3-4-6-12/h7-9,12,15-17H,3-6,10H2,1-2H3.
What are the key properties of 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol?
2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol has a molecular weight of 265.35 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-1-(3,5-dimethoxyphenyl)ethanol is sourced from PubChem (CID 110922411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).