3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one

C24H25NO2 — CID 110176581

IUPAC3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one
SMILESCC(O)(c1ccccc1)C(NCCC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C24H25NO2/c1-24(27,21-15-9-4-10-16-21)23(20-13-7-3-8-14-20)25-18-17-22(26)19-11-5-2-6-12-19/h2-16,23,25,27H,17-18H2,1H3
InChIKeyCBCQZGUYEVNHKL-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.50
Rot. Bonds8

About 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one

3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one (PubChem CID 110176581) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one.

Molecular Properties

Compound Name3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one
PubChem CID110176581
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC Name3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one
SMILESCC(O)(c1ccccc1)C(NCCC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C24H25NO2/c1-24(27,21-15-9-4-10-16-21)23(20-13-7-3-8-14-20)25-18-17-22(26)19-11-5-2-6-12-19/h2-16,23,25,27H,17-18H2,1H3
InChIKeyCBCQZGUYEVNHKL-UHFFFAOYSA-N
XLogP4.50
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one?
The IUPAC name of 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one (CID 110176581) is 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one.
What is the SMILES notation for 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one?
The canonical SMILES for 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one is CC(O)(c1ccccc1)C(NCCC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one?
The InChIKey is CBCQZGUYEVNHKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2/c1-24(27,21-15-9-4-10-16-21)23(20-13-7-3-8-14-20)25-18-17-22(26)19-11-5-2-6-12-19/h2-16,23,25,27H,17-18H2,1H3.
What are the key properties of 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one?
3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one has a molecular weight of 359.47 g/mol, XLogP of 4.50, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxy-1,2-diphenylpropyl)amino]-1-phenylpropan-1-one is sourced from PubChem (CID 110176581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).