N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine

C19H23NO — CID 116517454

IUPACN-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine
SMILESCCNC(COc1ccccc1)C1CC1c1ccccc1
InChIInChI=1S/C19H23NO/c1-2-20-19(14-21-16-11-7-4-8-12-16)18-13-17(18)15-9-5-3-6-10-15/h3-12,17-20H,2,13-14H2,1H3
InChIKeyAGXOZNWBOJAFEY-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.85
Rot. Bonds7

About N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine

N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine (PubChem CID 116517454) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine
PubChem CID116517454
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine
SMILESCCNC(COc1ccccc1)C1CC1c1ccccc1
InChIInChI=1S/C19H23NO/c1-2-20-19(14-21-16-11-7-4-8-12-16)18-13-17(18)15-9-5-3-6-10-15/h3-12,17-20H,2,13-14H2,1H3
InChIKeyAGXOZNWBOJAFEY-UHFFFAOYSA-N
XLogP3.85
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine
CID 116517453
N-ethyl-2-[(2-methylpropan-2-yl)oxy]-1-(2-phenylcyclopropyl)ethanamine
CID 105188962
N-ethyl-3,3,3-trifluoro-1-(2-phenylcyclopropyl)propan-1-amine
CID 116517402
N-ethyl-1-(2-ethylcyclohexyl)-2-phenoxyethanamine
CID 63862380
N-ethyl-4,4,4-trifluoro-1-(2-phenylcyclopropyl)butan-1-amine
CID 116517759
2-cycloheptyl-N-ethyl-1-(2-phenylcyclopropyl)ethanamine
CID 105052609
N-ethyl-1-(2-phenylcyclopropyl)-3-pyridin-3-ylpropan-1-amine
CID 105189087
N-ethyl-5,5,5-trifluoro-1-(2-phenylcyclopropyl)pentan-1-amine
CID 105024327
N-ethyl-1-(2-phenylcyclopropyl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103148555
2-(5-chlorothiophen-2-yl)-N-ethyl-1-(2-phenylcyclopropyl)ethanamine
CID 115841868
[2-ethoxy-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105235457
N-ethyl-2-methoxy-1-(2-phenylcyclopropyl)propan-1-amine
CID 116517740

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine?
The IUPAC name of N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine (CID 116517454) is N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine.
What is the SMILES notation for N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine?
The canonical SMILES for N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine is CCNC(COc1ccccc1)C1CC1c1ccccc1.
What is the InChIKey of N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine?
The InChIKey is AGXOZNWBOJAFEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-20-19(14-21-16-11-7-4-8-12-16)18-13-17(18)15-9-5-3-6-10-15/h3-12,17-20H,2,13-14H2,1H3.
What are the key properties of N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine?
N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine has a molecular weight of 281.40 g/mol, XLogP of 3.85, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine is sourced from PubChem (CID 116517454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).