3-[ethyl(propyl)amino]-1-phenylpropan-1-one

C14H21NO — CID 62614249

IUPAC3-[ethyl(propyl)amino]-1-phenylpropan-1-one
SMILESCCCN(CC)CCC(=O)c1ccccc1
InChIInChI=1S/C14H21NO/c1-3-11-15(4-2)12-10-14(16)13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3
InChIKeyPUZUZQDKPGKQIM-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.99
Rot. Bonds7

About 3-[ethyl(propyl)amino]-1-phenylpropan-1-one

3-[ethyl(propyl)amino]-1-phenylpropan-1-one (PubChem CID 62614249) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-[ethyl(propyl)amino]-1-phenylpropan-1-one.

Molecular Properties

Compound Name3-[ethyl(propyl)amino]-1-phenylpropan-1-one
PubChem CID62614249
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name3-[ethyl(propyl)amino]-1-phenylpropan-1-one
SMILESCCCN(CC)CCC(=O)c1ccccc1
InChIInChI=1S/C14H21NO/c1-3-11-15(4-2)12-10-14(16)13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3
InChIKeyPUZUZQDKPGKQIM-UHFFFAOYSA-N
XLogP2.99
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-[ethyl(propyl)amino]-1-phenylpropan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[ethyl(propyl)amino]-1-phenylbutan-1-one
CID 43792935
3-(diethylamino)-1-phenylpropan-1-one;hydrochloride
CID 13496280
2-[ethyl(propyl)amino]-1-phenylethanone
CID 43795306
3-(dibutylamino)-1-phenylpropan-1-one
CID 62614247
1-phenylbutan-1-one
CID 10315
3-[bis(2-hydroxyethyl)amino]-1-phenylpropan-1-one
CID 62611924
3-[ethyl(furan-2-ylmethyl)amino]-1-phenylpropan-1-one
CID 55094929
ethane;1-phenylpentan-1-one
CID 143728184
4-[ethyl(propyl)amino]-1-(4-fluorophenyl)butan-1-one
CID 43792937
1-phenylbutan-1-one;hydrobromide
CID 139638507
3-[benzyl-(3-oxo-3-phenylpropyl)amino]-1-phenylpropan-1-one
CID 135021147
methanethiol;1-phenylbutan-1-one
CID 143799522

Frequently Asked Questions

What is the IUPAC name of 3-[ethyl(propyl)amino]-1-phenylpropan-1-one?
The IUPAC name of 3-[ethyl(propyl)amino]-1-phenylpropan-1-one (CID 62614249) is 3-[ethyl(propyl)amino]-1-phenylpropan-1-one.
What is the SMILES notation for 3-[ethyl(propyl)amino]-1-phenylpropan-1-one?
The canonical SMILES for 3-[ethyl(propyl)amino]-1-phenylpropan-1-one is CCCN(CC)CCC(=O)c1ccccc1.
What is the InChIKey of 3-[ethyl(propyl)amino]-1-phenylpropan-1-one?
The InChIKey is PUZUZQDKPGKQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-3-11-15(4-2)12-10-14(16)13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3.
What are the key properties of 3-[ethyl(propyl)amino]-1-phenylpropan-1-one?
3-[ethyl(propyl)amino]-1-phenylpropan-1-one has a molecular weight of 219.33 g/mol, XLogP of 2.99, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl(propyl)amino]-1-phenylpropan-1-one is sourced from PubChem (CID 62614249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).