2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide

C26H28N2O — CID 60575227

IUPAC2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide
SMILESO=C(Nc1ccc(CCN2CCCC2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H28N2O/c29-26(25(22-9-3-1-4-10-22)23-11-5-2-6-12-23)27-24-15-13-21(14-16-24)17-20-28-18-7-8-19-28/h1-6,9-16,25H,7-8,17-20H2,(H,27,29)
InChIKeyFCNQJWLDWCQKAY-UHFFFAOYSA-N
MW384.52 g/mol
LogP5.10
Rot. Bonds7

About 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide

2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide (PubChem CID 60575227) has the molecular formula C26H28N2O and a molecular weight of 384.52 g/mol. Its IUPAC name is 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide
PubChem CID60575227
Molecular FormulaC26H28N2O
Molecular Weight384.52 g/mol
Exact Mass384.22
IUPAC Name2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide
SMILESO=C(Nc1ccc(CCN2CCCC2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H28N2O/c29-26(25(22-9-3-1-4-10-22)23-11-5-2-6-12-23)27-24-15-13-21(14-16-24)17-20-28-18-7-8-19-28/h1-6,9-16,25H,7-8,17-20H2,(H,27,29)
InChIKeyFCNQJWLDWCQKAY-UHFFFAOYSA-N
XLogP5.10
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.52
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-3-phenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]propanamide
CID 119862104
N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide
CID 60575256
2-amino-2-(oxan-4-yl)-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide
CID 120798942
1-phenyl-3-[4-(3-pyrrolidin-1-ylpropyl)phenyl]urea
CID 110314409
3-amino-2-methyl-3-phenyl-N-[4-(2-thiomorpholin-4-ylethyl)phenyl]propanamide;dihydrochloride
CID 119869844
N-(4-chlorophenyl)-4-(2-pyrrolidin-1-ylethyl)benzamide
CID 70967822
N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]-2,2-diphenylacetamide
CID 16612010
1-[2-[4-(2-ethylbutanoylamino)phenyl]ethyl]piperidine-4-carboxylic acid
CID 82260370
2-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120798857
2-amino-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]-2-phenylacetamide;hydrochloride
CID 119303626
2,2-diphenyl-N-[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]acetamide
CID 57190770
(2S)-N-(4-methoxyphenyl)-2-[4-(2-phenylethyl)piperazin-1-yl]propanamide
CID 30738398

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide?
The IUPAC name of 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide (CID 60575227) is 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide.
What is the SMILES notation for 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide?
The canonical SMILES for 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide is O=C(Nc1ccc(CCN2CCCC2)cc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide?
The InChIKey is FCNQJWLDWCQKAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N2O/c29-26(25(22-9-3-1-4-10-22)23-11-5-2-6-12-23)27-24-15-13-21(14-16-24)17-20-28-18-7-8-19-28/h1-6,9-16,25H,7-8,17-20H2,(H,27,29).
What are the key properties of 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide?
2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide has a molecular weight of 384.52 g/mol, XLogP of 5.10, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide is sourced from PubChem (CID 60575227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).