1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one

C15H23NO — CID 43795382

IUPAC1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one
SMILESCCCN(C(C)C)C(C)C(=O)c1ccccc1
InChIInChI=1S/C15H23NO/c1-5-11-16(12(2)3)13(4)15(17)14-9-7-6-8-10-14/h6-10,12-13H,5,11H2,1-4H3
InChIKeyCDUDLKFZHNZNGL-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.38
Rot. Bonds6

About 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one

1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one (PubChem CID 43795382) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one.

Molecular Properties

Compound Name1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one
PubChem CID43795382
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one
SMILESCCCN(C(C)C)C(C)C(=O)c1ccccc1
InChIInChI=1S/C15H23NO/c1-5-11-16(12(2)3)13(4)15(17)14-9-7-6-8-10-14/h6-10,12-13H,5,11H2,1-4H3
InChIKeyCDUDLKFZHNZNGL-UHFFFAOYSA-N
XLogP3.38
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one
CID 82952096
2-[(1-oxo-1-phenylpropan-2-yl)-propan-2-ylamino]acetamide
CID 60680052
2-[ethyl(methyl)amino]-1-phenylpropan-1-one
CID 43794825
1-(4-methylphenyl)-2-[pentyl(propan-2-yl)amino]propan-1-one
CID 63567711
(2S)-2-[propan-2-yl(propyl)amino]propanoic acid
CID 151330879
1-phenyl-2-propoxypropan-1-one
CID 43801137
2-[(2-amino-2-oxoethyl)-(1-oxo-1-phenylpropan-2-yl)amino]acetamide
CID 62921694
2-[methyl(pentan-3-yl)amino]-1-phenylpropan-1-one
CID 43796822
propyl N-methyl-N-(1-oxo-1-phenylpropan-2-yl)carbamate
CID 91747711
2-[ethyl-(1-oxo-1-phenylpropan-2-yl)amino]acetamide
CID 103103066
2-fluoro-3-methyl-1-phenylpentan-1-one
CID 10965397
2-[methyl(2-phenylethyl)amino]-1-phenylpropan-1-one
CID 65487247

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one?
The IUPAC name of 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one (CID 43795382) is 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one.
What is the SMILES notation for 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one?
The canonical SMILES for 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one is CCCN(C(C)C)C(C)C(=O)c1ccccc1.
What is the InChIKey of 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one?
The InChIKey is CDUDLKFZHNZNGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-5-11-16(12(2)3)13(4)15(17)14-9-7-6-8-10-14/h6-10,12-13H,5,11H2,1-4H3.
What are the key properties of 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one?
1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one has a molecular weight of 233.36 g/mol, XLogP of 3.38, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one is sourced from PubChem (CID 43795382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).