2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol

C15H23NO2 — CID 62015643

IUPAC2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol
SMILESCOc1ccc(CN(CCO)C2CCCC2)cc1
InChIInChI=1S/C15H23NO2/c1-18-15-8-6-13(7-9-15)12-16(10-11-17)14-4-2-3-5-14/h6-9,14,17H,2-5,10-12H2,1H3
InChIKeyAJMWUTFOODJLET-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.43
Rot. Bonds6

About 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol

2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol (PubChem CID 62015643) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol
PubChem CID62015643
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol
SMILESCOc1ccc(CN(CCO)C2CCCC2)cc1
InChIInChI=1S/C15H23NO2/c1-18-15-8-6-13(7-9-15)12-16(10-11-17)14-4-2-3-5-14/h6-9,14,17H,2-5,10-12H2,1H3
InChIKeyAJMWUTFOODJLET-UHFFFAOYSA-N
XLogP2.43
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-[(4-methoxyphenyl)methyl]cyclohexanamine
CID 112818440
2-[(2-bromo-5-methoxyphenyl)methyl-cyclopentylamino]ethanol
CID 65326761
4-[[cyclobutyl(2-hydroxyethyl)amino]methyl]phenol
CID 102809822
2-[[4-(aminomethyl)phenyl]methyl-cyclohexylamino]ethanol
CID 54993281
2-[cyclohexyl-[(4-iodophenyl)methyl]amino]ethanol
CID 65478154
2-[cyclobutyl-[(4-fluorophenyl)methyl]amino]ethanol
CID 102676667
3-[cyclobutyl-[2-(4-methoxyphenyl)ethyl]amino]propan-1-ol
CID 102848724
2-[cyclopentyl(pyridin-4-ylmethyl)amino]ethanol
CID 62014276
2-[cyclopentyl-[(3,4-dimethylphenyl)methyl]amino]ethanol
CID 62015858
2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol
CID 131920208
[(1S,2S)-2-[bis[(4-methoxyphenyl)methyl]amino]cyclopentyl]methanol
CID 154928225
2-[cyclopentyl(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)acetamide
CID 60911412

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol?
The IUPAC name of 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol (CID 62015643) is 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol?
The canonical SMILES for 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol is COc1ccc(CN(CCO)C2CCCC2)cc1.
What is the InChIKey of 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol?
The InChIKey is AJMWUTFOODJLET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-18-15-8-6-13(7-9-15)12-16(10-11-17)14-4-2-3-5-14/h6-9,14,17H,2-5,10-12H2,1H3.
What are the key properties of 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol?
2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol has a molecular weight of 249.35 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol is sourced from PubChem (CID 62015643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).