1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol

C15H23NO2 — CID 66336099

IUPAC1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol
SMILESCCc1ccccc1OCC(C)(O)CNC1CC1
InChIInChI=1S/C15H23NO2/c1-3-12-6-4-5-7-14(12)18-11-15(2,17)10-16-13-8-9-13/h4-7,13,16-17H,3,8-11H2,1-2H3
InChIKeyQAPWOQHPSNZUGV-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.13
Rot. Bonds7

About 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol

1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol (PubChem CID 66336099) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol
PubChem CID66336099
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol
SMILESCCc1ccccc1OCC(C)(O)CNC1CC1
InChIInChI=1S/C15H23NO2/c1-3-12-6-4-5-7-14(12)18-11-15(2,17)10-16-13-8-9-13/h4-7,13,16-17H,3,8-11H2,1-2H3
InChIKeyQAPWOQHPSNZUGV-UHFFFAOYSA-N
XLogP2.13
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chlorophenoxy)-3-(cyclopropylamino)-2-methylpropan-2-ol
CID 66336227
2-[3-(cyclopropylamino)-2-hydroxy-2-methylpropoxy]benzonitrile
CID 66335480
1-(cyclopropylamino)-3-(2-fluoro-3-methylphenoxy)-2-methylpropan-2-ol
CID 107657515
1-(1-bromonaphthalen-2-yl)oxy-3-(cyclopropylamino)-2-methylpropan-2-ol
CID 66335499
N-[2-[(2-ethylphenoxy)methyl]prop-2-enyl]cyclopropanamine
CID 103066925
N-[2-(2-ethylphenoxy)ethyl]cyclopropanamine
CID 43364345
N-[3-(2-ethylphenoxy)-2-methylpropyl]cyclopropanamine
CID 62484643
1-(5-bromo-2-methylphenoxy)-3-(cyclopropylamino)-2-methylpropan-2-ol
CID 107283630
2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylphenoxy)propanoic acid
CID 63918658
1-(4-bromo-2-chlorophenoxy)-3-(cyclopropylamino)-2-methylpropan-2-ol
CID 66336244
N-[2,2-dimethyl-3-(2-propoxyphenoxy)propyl]cyclopropanamine
CID 79628062
N-[4-[3-(cyclopropylamino)-2-hydroxy-2-methylpropoxy]phenyl]acetamide
CID 66336225

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol?
The IUPAC name of 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol (CID 66336099) is 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol?
The canonical SMILES for 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol is CCc1ccccc1OCC(C)(O)CNC1CC1.
What is the InChIKey of 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol?
The InChIKey is QAPWOQHPSNZUGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-12-6-4-5-7-14(12)18-11-15(2,17)10-16-13-8-9-13/h4-7,13,16-17H,3,8-11H2,1-2H3.
What are the key properties of 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol?
1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol has a molecular weight of 249.35 g/mol, XLogP of 2.13, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol is sourced from PubChem (CID 66336099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).