2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol

C12H17NO2 — CID 61054205

IUPAC2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol
SMILESCOc1cccc(C(CO)NC2CC2)c1
InChIInChI=1S/C12H17NO2/c1-15-11-4-2-3-9(7-11)12(8-14)13-10-5-6-10/h2-4,7,10,12-14H,5-6,8H2,1H3
InChIKeyCDLFEXKDCZCHMX-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.48
Rot. Bonds5

About 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol

2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol (PubChem CID 61054205) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol.

Molecular Properties

Compound Name2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol
PubChem CID61054205
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol
SMILESCOc1cccc(C(CO)NC2CC2)c1
InChIInChI=1S/C12H17NO2/c1-15-11-4-2-3-9(7-11)12(8-14)13-10-5-6-10/h2-4,7,10,12-14H,5-6,8H2,1H3
InChIKeyCDLFEXKDCZCHMX-UHFFFAOYSA-N
XLogP1.48
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclohexylamino)-2-(3-ethoxyphenyl)ethanol
CID 61047485
2-(cyclopropylamino)-2-(3-fluorophenyl)ethanol
CID 61055012
(2S)-2-(cyclopropylamino)-2-phenylethanol
CID 93471499
4-ethyl-N-[(1R)-1-(3-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 81376641
2-(cyclopropylamino)-2-(3-fluoro-4-methoxyphenyl)ethanol
CID 65101361
2-bromo-2-(3-methoxyphenyl)ethanol
CID 22371552
N-[(1S)-1-(3-methoxyphenyl)ethyl]-4-propylcyclohexan-1-amine
CID 81375811
(2S)-2-phenyl-2-[(4-propan-2-ylcyclohexyl)amino]ethanol
CID 103784113
2-(cyclopentylamino)-1-(3-methoxyphenyl)-3-methylbutan-1-ol
CID 82314327
2-(cyclopentylamino)-2-(2,4-dimethoxyphenyl)ethanol
CID 61056168
2-(cyclohexylamino)-1-(3-methoxyphenyl)butan-1-ol
CID 82314292
(2R)-2-[1-(3-methoxyphenyl)propylamino]propan-1-ol
CID 103778510

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol?
The IUPAC name of 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol (CID 61054205) is 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol.
What is the SMILES notation for 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol?
The canonical SMILES for 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol is COc1cccc(C(CO)NC2CC2)c1.
What is the InChIKey of 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol?
The InChIKey is CDLFEXKDCZCHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-15-11-4-2-3-9(7-11)12(8-14)13-10-5-6-10/h2-4,7,10,12-14H,5-6,8H2,1H3.
What are the key properties of 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol?
2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol has a molecular weight of 207.27 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-2-(3-methoxyphenyl)ethanol is sourced from PubChem (CID 61054205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).