2-(dipropylamino)-1-(4-phenylphenyl)ethanone

C20H25NO — CID 82051052

IUPAC2-(dipropylamino)-1-(4-phenylphenyl)ethanone
SMILESCCCN(CCC)CC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H25NO/c1-3-14-21(15-4-2)16-20(22)19-12-10-18(11-13-19)17-8-6-5-7-9-17/h5-13H,3-4,14-16H2,1-2H3
InChIKeyBXBABPGVVBVVIG-UHFFFAOYSA-N
MW295.43 g/mol
LogP4.66
Rot. Bonds8

About 2-(dipropylamino)-1-(4-phenylphenyl)ethanone

2-(dipropylamino)-1-(4-phenylphenyl)ethanone (PubChem CID 82051052) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 2-(dipropylamino)-1-(4-phenylphenyl)ethanone.

Molecular Properties

Compound Name2-(dipropylamino)-1-(4-phenylphenyl)ethanone
PubChem CID82051052
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name2-(dipropylamino)-1-(4-phenylphenyl)ethanone
SMILESCCCN(CCC)CC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H25NO/c1-3-14-21(15-4-2)16-20(22)19-12-10-18(11-13-19)17-8-6-5-7-9-17/h5-13H,3-4,14-16H2,1-2H3
InChIKeyBXBABPGVVBVVIG-UHFFFAOYSA-N
XLogP4.66
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(dipropylamino)-1-(4-phenylphenyl)ethanone 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

2-[ethyl(propyl)amino]-1-phenylethanone
CID 43795306
2-(dimethylamino)-1-(4-phenylphenyl)ethanone
CID 768313
2-(dimethylamino)-1-(4-phenylphenyl)ethanone;hydrochloride
CID 117066734
2-(dibutylamino)-1-(4-methylphenyl)ethanone
CID 43219615
ethane;4-phenylbenzoic acid;propane
CID 156791718
3-[ethyl(propyl)amino]-1-phenylpropan-1-one
CID 62614249
2-[bis(2-methoxyethyl)amino]-1-phenylethanone
CID 60649797
1-[4-[2-(4-phenylphenyl)ethynyl]phenyl]propan-1-one
CID 139662703
CID 162409088
CID 162409088
2-[[2-(4-hydroxyphenyl)-2-oxoethyl]-propylamino]-N,N-dimethylacetamide
CID 62030928
1-(4-fluorophenyl)-2-[propyl(2,2,2-trifluoroethyl)amino]ethanone
CID 55138272
4-[ethyl(propyl)amino]-1-phenylbutan-1-one
CID 43792935

Frequently Asked Questions

What is the IUPAC name of 2-(dipropylamino)-1-(4-phenylphenyl)ethanone?
The IUPAC name of 2-(dipropylamino)-1-(4-phenylphenyl)ethanone (CID 82051052) is 2-(dipropylamino)-1-(4-phenylphenyl)ethanone.
What is the SMILES notation for 2-(dipropylamino)-1-(4-phenylphenyl)ethanone?
The canonical SMILES for 2-(dipropylamino)-1-(4-phenylphenyl)ethanone is CCCN(CCC)CC(=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-(dipropylamino)-1-(4-phenylphenyl)ethanone?
The InChIKey is BXBABPGVVBVVIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-3-14-21(15-4-2)16-20(22)19-12-10-18(11-13-19)17-8-6-5-7-9-17/h5-13H,3-4,14-16H2,1-2H3.
What are the key properties of 2-(dipropylamino)-1-(4-phenylphenyl)ethanone?
2-(dipropylamino)-1-(4-phenylphenyl)ethanone has a molecular weight of 295.43 g/mol, XLogP of 4.66, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dipropylamino)-1-(4-phenylphenyl)ethanone is sourced from PubChem (CID 82051052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).