N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide

C23H25N3O3 — CID 131896576

IUPACN-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide
SMILESO=C(CN1CC(c2ccccc2)CC1=O)Nc1ccc(CC(=O)NC2CC2)cc1
InChIInChI=1S/C23H25N3O3/c27-21(24-20-10-11-20)12-16-6-8-19(9-7-16)25-22(28)15-26-14-18(13-23(26)29)17-4-2-1-3-5-17/h1-9,18,20H,10-15H2,(H,24,27)(H,25,28)
InChIKeyVLYSEQBZQZBFKT-UHFFFAOYSA-N
MW391.47 g/mol
LogP2.46
Rot. Bonds7

About N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide

N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide (PubChem CID 131896576) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide
PubChem CID131896576
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC NameN-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide
SMILESO=C(CN1CC(c2ccccc2)CC1=O)Nc1ccc(CC(=O)NC2CC2)cc1
InChIInChI=1S/C23H25N3O3/c27-21(24-20-10-11-20)12-16-6-8-19(9-7-16)25-22(28)15-26-14-18(13-23(26)29)17-4-2-1-3-5-17/h1-9,18,20H,10-15H2,(H,24,27)(H,25,28)
InChIKeyVLYSEQBZQZBFKT-UHFFFAOYSA-N
XLogP2.46
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide (CID 131896576) is N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide is O=C(CN1CC(c2ccccc2)CC1=O)Nc1ccc(CC(=O)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide?
The InChIKey is VLYSEQBZQZBFKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c27-21(24-20-10-11-20)12-16-6-8-19(9-7-16)25-22(28)15-26-14-18(13-23(26)29)17-4-2-1-3-5-17/h1-9,18,20H,10-15H2,(H,24,27)(H,25,28).
What are the key properties of N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide?
N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide has a molecular weight of 391.47 g/mol, XLogP of 2.46, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-[[2-(2-oxo-4-phenylpyrrolidin-1-yl)acetyl]amino]phenyl]acetamide is sourced from PubChem (CID 131896576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).