2-(2-aminoethoxy)-1,2-diphenylpentan-1-one

C19H23NO2 — CID 67632369

IUPAC2-(2-aminoethoxy)-1,2-diphenylpentan-1-one
SMILESCCCC(OCCN)(C(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-2-13-19(22-15-14-20,17-11-7-4-8-12-17)18(21)16-9-5-3-6-10-16/h3-12H,2,13-15,20H2,1H3
InChIKeyDQTHNPFQWYXKRF-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.54
Rot. Bonds8

About 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one

2-(2-aminoethoxy)-1,2-diphenylpentan-1-one (PubChem CID 67632369) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one.

Molecular Properties

Compound Name2-(2-aminoethoxy)-1,2-diphenylpentan-1-one
PubChem CID67632369
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-(2-aminoethoxy)-1,2-diphenylpentan-1-one
SMILESCCCC(OCCN)(C(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-2-13-19(22-15-14-20,17-11-7-4-8-12-17)18(21)16-9-5-3-6-10-16/h3-12H,2,13-15,20H2,1H3
InChIKeyDQTHNPFQWYXKRF-UHFFFAOYSA-N
XLogP3.54
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-butoxy-1,2,3-triphenylpropan-1-one
CID 154411590
4-hexoxy-5-oxo-4,5-diphenylpentanoic acid
CID 154411602
2,2-dibromo-1-phenylpentan-1-one
CID 15696195
2-(2-methylpropoxy)-1,2,3-triphenylpropan-1-one
CID 67441475
diphenylmethanone;propan-1-amine
CID 174497329
2,2-bis(2-methoxyethoxy)-1,2-diphenylethanone
CID 14762562
2-ethyl-1,2-diphenylbutan-1-one
CID 21330983
1-butoxybutane;2-hydroxy-1,2,3-triphenylpropan-1-one
CID 70616091
(3-hydroxy-1-oxo-1,2-diphenylpropan-2-yl) decane-1-sulfonate
CID 87118727
(111C)butyl benzoate
CID 11994383
ethyl (2S)-2-bromo-2-methyl-3-oxo-3-phenylpropanoate
CID 101364316
1,1-diphenyl-1-propoxypropan-2-one
CID 13040855

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one?
The IUPAC name of 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one (CID 67632369) is 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one.
What is the SMILES notation for 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one?
The canonical SMILES for 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one is CCCC(OCCN)(C(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one?
The InChIKey is DQTHNPFQWYXKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-2-13-19(22-15-14-20,17-11-7-4-8-12-17)18(21)16-9-5-3-6-10-16/h3-12H,2,13-15,20H2,1H3.
What are the key properties of 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one?
2-(2-aminoethoxy)-1,2-diphenylpentan-1-one has a molecular weight of 297.40 g/mol, XLogP of 3.54, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-1,2-diphenylpentan-1-one is sourced from PubChem (CID 67632369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).