[2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone

C17H19NO2 — CID 67045669

IUPAC[2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone
SMILESCCNc1cccc(C(=O)c2ccccc2)c1OCC
InChIInChI=1S/C17H19NO2/c1-3-18-15-12-8-11-14(17(15)20-4-2)16(19)13-9-6-5-7-10-13/h5-12,18H,3-4H2,1-2H3
InChIKeyGOTZHWSVYZYACB-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.75
Rot. Bonds6

About [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone

[2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone (PubChem CID 67045669) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone
PubChem CID67045669
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name[2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone
SMILESCCNc1cccc(C(=O)c2ccccc2)c1OCC
InChIInChI=1S/C17H19NO2/c1-3-18-15-12-8-11-14(17(15)20-4-2)16(19)13-9-6-5-7-10-13/h5-12,18H,3-4H2,1-2H3
InChIKeyGOTZHWSVYZYACB-UHFFFAOYSA-N
XLogP3.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(ethylamino)phenyl]-phenylmethanone
CID 3661027
diethyl 2-[(2-benzoylanilino)methylidene]propanedioate
CID 45050878
2,3-diethoxyphenol;diphenylmethanone
CID 159024064
(E)-3-(2-benzoylanilino)-1-(4-ethoxyphenyl)prop-2-en-1-one
CID 46858582
[3-hydroxy-2-(2-hydroxypropoxy)phenyl]-phenylmethanone
CID 139913543
ethyl 3-(2-benzoylanilino)-2-cyanoprop-2-enoate
CID 4652314
(2-chloro-4,5-diethoxyphenyl)-phenylmethanone
CID 43340750
[2-(but-2-enylamino)phenyl]-phenylmethanone
CID 163414634
phenyl-[2-(pyrimidin-2-ylmethylamino)phenyl]methanone
CID 119051507
ethyl 4-[(2-benzoylphenyl)carbamoylamino]benzoate
CID 46859858
[2-[[amino(naphthalen-1-yl)methyl]amino]phenyl]-phenylmethanone
CID 110827243
2-(2-benzoylanilino)-1-(4-methylphenyl)ethanone
CID 110825945

Frequently Asked Questions

What is the IUPAC name of [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone?
The IUPAC name of [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone (CID 67045669) is [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone.
What is the SMILES notation for [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone?
The canonical SMILES for [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone is CCNc1cccc(C(=O)c2ccccc2)c1OCC.
What is the InChIKey of [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone?
The InChIKey is GOTZHWSVYZYACB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-3-18-15-12-8-11-14(17(15)20-4-2)16(19)13-9-6-5-7-10-13/h5-12,18H,3-4H2,1-2H3.
What are the key properties of [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone?
[2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone has a molecular weight of 269.34 g/mol, XLogP of 3.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethoxy-3-(ethylamino)phenyl]-phenylmethanone is sourced from PubChem (CID 67045669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).