1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol

C15H23NO2 — CID 55171592

IUPAC1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol
SMILESCOc1cc(C)ccc1C(C)NCC(O)C1CC1
InChIInChI=1S/C15H23NO2/c1-10-4-7-13(15(8-10)18-3)11(2)16-9-14(17)12-5-6-12/h4,7-8,11-12,14,16-17H,5-6,9H2,1-3H3
InChIKeyUDXYBJHFEFOLAV-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.43
Rot. Bonds6

About 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol

1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol (PubChem CID 55171592) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol
PubChem CID55171592
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol
SMILESCOc1cc(C)ccc1C(C)NCC(O)C1CC1
InChIInChI=1S/C15H23NO2/c1-10-4-7-13(15(8-10)18-3)11(2)16-9-14(17)12-5-6-12/h4,7-8,11-12,14,16-17H,5-6,9H2,1-3H3
InChIKeyUDXYBJHFEFOLAV-UHFFFAOYSA-N
XLogP2.43
TPSA41.49 Ų
H-Bond Donors2
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 ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-2-[1-(2,4-dimethoxyphenyl)ethylamino]ethanol
CID 63294530
N-[1-(2-methoxy-4-methylphenyl)ethyl]-3-methyl-2-propan-2-ylbutan-1-amine
CID 102904386
3-ethyl-1-[1-(2-methoxy-4-methylphenyl)ethylamino]pentan-2-ol
CID 103783067
1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol
CID 63294182
1-cyclopropyl-2-[1-(3,4,5-trimethoxyphenyl)ethylamino]ethanol
CID 63295210
N-[1-(2-methoxy-4-methylphenyl)ethyl]-2-methylsulfinylpropan-1-amine
CID 115896280
1-cyclopropyl-2-[1-(2,4-dichlorophenyl)ethylamino]ethanol
CID 63294934
1-(2-methoxy-4-methylphenyl)-N-(oxolan-3-ylmethyl)ethanamine
CID 54932279
1-cyclopropyl-2-(2-methoxy-4-methylphenoxy)ethanol
CID 63907448
2-[1-(2-bromophenyl)ethylamino]-1-cyclopropylethanol
CID 63294580
3-[[1-(2-methoxy-4-methylphenyl)ethylamino]methyl]pentan-3-ol
CID 65105446
[4-[[1-(2-methoxy-4-methylphenyl)ethylamino]methyl]phenyl]methanol
CID 107230187

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol?
The IUPAC name of 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol (CID 55171592) is 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol.
What is the SMILES notation for 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol?
The canonical SMILES for 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol is COc1cc(C)ccc1C(C)NCC(O)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol?
The InChIKey is UDXYBJHFEFOLAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-10-4-7-13(15(8-10)18-3)11(2)16-9-14(17)12-5-6-12/h4,7-8,11-12,14,16-17H,5-6,9H2,1-3H3.
What are the key properties of 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol?
1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol has a molecular weight of 249.35 g/mol, XLogP of 2.43, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol is sourced from PubChem (CID 55171592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).