2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide

C25H33N3O — CID 70460207

IUPAC2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide
SMILESNC(=O)CC1CCN(CCN2CCCCC2)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H33N3O/c26-24(29)20-23-14-17-28(19-18-27-15-8-3-9-16-27)25(23,21-10-4-1-5-11-21)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H2,26,29)
InChIKeyQEYMWVRALRCZHC-UHFFFAOYSA-N
MW391.56 g/mol
LogP3.61
Rot. Bonds7

About 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide

2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide (PubChem CID 70460207) has the molecular formula C25H33N3O and a molecular weight of 391.56 g/mol. Its IUPAC name is 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound Name2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide
PubChem CID70460207
Molecular FormulaC25H33N3O
Molecular Weight391.56 g/mol
Exact Mass391.26
IUPAC Name2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide
SMILESNC(=O)CC1CCN(CCN2CCCCC2)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H33N3O/c26-24(29)20-23-14-17-28(19-18-27-15-8-3-9-16-27)25(23,21-10-4-1-5-11-21)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H2,26,29)
InChIKeyQEYMWVRALRCZHC-UHFFFAOYSA-N
XLogP3.61
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.56
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-benzyl-2,2-diphenylpyrrolidin-3-yl)acetamide
CID 57119129
2-[(1S)-1-phenyl-6-(2-pyrrolidin-1-ylethyl)cyclohexa-2,4-dien-1-yl]acetamide;hydrochloride
CID 142645475
2-piperidin-1-ylethyl (1S)-2,2-diphenylcyclopropane-1-carboxylate
CID 76961064
2,2-diphenyl-N-(2-piperidin-1-ylethyl)cyclopropane-1-carboxamide
CID 171979462
methyl 1-phenyl-2-(piperidin-1-ylmethyl)cyclobutane-1-carboxylate
CID 70277896
1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide
CID 4294813
4-(2,2-diphenylpiperidin-1-yl)butanamide
CID 19992345
2-[1-(3-oxo-3-phenylpropyl)piperidin-4-yl]acetamide
CID 115926022
N-methyl-N-phenyl-3-piperidin-1-ylpropanamide
CID 110688340
2-amino-4-(azocan-1-yl)-2-phenylbutanamide
CID 116693501
2-cyclohexyl-2-phenyl-4-piperidin-1-ylbutanamide;oxalic acid
CID 24842549
(E)-but-2-enedioic acid;3-ethoxy-3-phenyl-1-(2-piperidin-1-ylethyl)indol-2-one;hydrate
CID 20838274

Frequently Asked Questions

What is the IUPAC name of 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide?
The IUPAC name of 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide (CID 70460207) is 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide.
What is the SMILES notation for 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide?
The canonical SMILES for 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide is NC(=O)CC1CCN(CCN2CCCCC2)C1(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide?
The InChIKey is QEYMWVRALRCZHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33N3O/c26-24(29)20-23-14-17-28(19-18-27-15-8-3-9-16-27)25(23,21-10-4-1-5-11-21)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H2,26,29).
What are the key properties of 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide?
2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide has a molecular weight of 391.56 g/mol, XLogP of 3.61, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,2-diphenyl-1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 70460207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).