N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide

C24H27N3O — CID 55766346

IUPACN-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide
SMILESO=C(CN1CCCC1c1ccc[nH]1)NC(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C24H27N3O/c28-24(18-27-16-8-14-23(27)21-13-7-15-25-21)26-22(20-11-5-2-6-12-20)17-19-9-3-1-4-10-19/h1-7,9-13,15,22-23,25H,8,14,16-18H2,(H,26,28)
InChIKeyYXYWQWYRZOIRSV-UHFFFAOYSA-N
MW373.50 g/mol
LogP4.25
Rot. Bonds7

About N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide

N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide (PubChem CID 55766346) has the molecular formula C24H27N3O and a molecular weight of 373.50 g/mol. Its IUPAC name is N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide
PubChem CID55766346
Molecular FormulaC24H27N3O
Molecular Weight373.50 g/mol
Exact Mass373.22
IUPAC NameN-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide
SMILESO=C(CN1CCCC1c1ccc[nH]1)NC(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C24H27N3O/c28-24(18-27-16-8-14-23(27)21-13-7-15-25-21)26-22(20-11-5-2-6-12-20)17-19-9-3-1-4-10-19/h1-7,9-13,15,22-23,25H,8,14,16-18H2,(H,26,28)
InChIKeyYXYWQWYRZOIRSV-UHFFFAOYSA-N
XLogP4.25
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide?
The IUPAC name of N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide (CID 55766346) is N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide.
What is the SMILES notation for N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide?
The canonical SMILES for N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide is O=C(CN1CCCC1c1ccc[nH]1)NC(Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide?
The InChIKey is YXYWQWYRZOIRSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O/c28-24(18-27-16-8-14-23(27)21-13-7-15-25-21)26-22(20-11-5-2-6-12-20)17-19-9-3-1-4-10-19/h1-7,9-13,15,22-23,25H,8,14,16-18H2,(H,26,28).
What are the key properties of N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide?
N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide has a molecular weight of 373.50 g/mol, XLogP of 4.25, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-diphenylethyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide is sourced from PubChem (CID 55766346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).