N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide

C25H26N2O3 — CID 53463263

IUPACN-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide
SMILESO=C(NC(Cc1ccccc1)C(=O)NC(CO)Cc1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O3/c28-18-22(16-19-10-4-1-5-11-19)26-25(30)23(17-20-12-6-2-7-13-20)27-24(29)21-14-8-3-9-15-21/h1-15,22-23,28H,16-18H2,(H,26,30)(H,27,29)
InChIKeyKSVKECXWDNCRTM-UHFFFAOYSA-N
MW402.49 g/mol
LogP2.75
Rot. Bonds9

About N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide

N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide (PubChem CID 53463263) has the molecular formula C25H26N2O3 and a molecular weight of 402.49 g/mol. Its IUPAC name is N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide.

Molecular Properties

Compound NameN-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide
PubChem CID53463263
Molecular FormulaC25H26N2O3
Molecular Weight402.49 g/mol
Exact Mass402.19
IUPAC NameN-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide
SMILESO=C(NC(Cc1ccccc1)C(=O)NC(CO)Cc1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O3/c28-18-22(16-19-10-4-1-5-11-19)26-25(30)23(17-20-12-6-2-7-13-20)27-24(29)21-14-8-3-9-15-21/h1-15,22-23,28H,16-18H2,(H,26,30)(H,27,29)
InChIKeyKSVKECXWDNCRTM-UHFFFAOYSA-N
XLogP2.75
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 52.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide?
The IUPAC name of N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide (CID 53463263) is N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide.
What is the SMILES notation for N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide?
The canonical SMILES for N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide is O=C(NC(Cc1ccccc1)C(=O)NC(CO)Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide?
The InChIKey is KSVKECXWDNCRTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O3/c28-18-22(16-19-10-4-1-5-11-19)26-25(30)23(17-20-12-6-2-7-13-20)27-24(29)21-14-8-3-9-15-21/h1-15,22-23,28H,16-18H2,(H,26,30)(H,27,29).
What are the key properties of N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide?
N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide has a molecular weight of 402.49 g/mol, XLogP of 2.75, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide is sourced from PubChem (CID 53463263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).