2,2-bis(1-phenylpyrrolidin-3-yl)acetamide

C22H27N3O — CID 70460540

IUPAC2,2-bis(1-phenylpyrrolidin-3-yl)acetamide
SMILESNC(=O)C(C1CCN(c2ccccc2)C1)C1CCN(c2ccccc2)C1
InChIInChI=1S/C22H27N3O/c23-22(26)21(17-11-13-24(15-17)19-7-3-1-4-8-19)18-12-14-25(16-18)20-9-5-2-6-10-20/h1-10,17-18,21H,11-16H2,(H2,23,26)
InChIKeyAANPGNMZVSOZSY-UHFFFAOYSA-N
MW349.48 g/mol
LogP3.14
Rot. Bonds5

About 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide

2,2-bis(1-phenylpyrrolidin-3-yl)acetamide (PubChem CID 70460540) has the molecular formula C22H27N3O and a molecular weight of 349.48 g/mol. Its IUPAC name is 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide.

Molecular Properties

Compound Name2,2-bis(1-phenylpyrrolidin-3-yl)acetamide
PubChem CID70460540
Molecular FormulaC22H27N3O
Molecular Weight349.48 g/mol
Exact Mass349.22
IUPAC Name2,2-bis(1-phenylpyrrolidin-3-yl)acetamide
SMILESNC(=O)C(C1CCN(c2ccccc2)C1)C1CCN(c2ccccc2)C1
InChIInChI=1S/C22H27N3O/c23-22(26)21(17-11-13-24(15-17)19-7-3-1-4-8-19)18-12-14-25(16-18)20-9-5-2-6-10-20/h1-10,17-18,21H,11-16H2,(H2,23,26)
InChIKeyAANPGNMZVSOZSY-UHFFFAOYSA-N
XLogP3.14
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-2-(1-phenylpiperidin-4-yl)acetic acid
CID 106820681
1-(1-phenylpyrrolidin-3-yl)propan-1-amine
CID 83981120
2-amino-2-[1-(4-fluorophenyl)pyrrolidin-3-yl]acetic acid
CID 83981558
(3R)-1-phenylpyrrolidin-3-amine
CID 51663648
1-phenylpyrrolidin-3-ol
CID 11171152
(3S)-1-phenylpyrrolidin-3-amine;2,2,2-trifluoroacetic acid
CID 122677958
(1-phenylpiperidin-3-yl)urea
CID 121416777
1-[4-[3-(1-hydroxyethyl)pyrrolidin-1-yl]phenyl]ethanone
CID 112625956
1-cyclopropyl-3-[(3S)-1-phenylpyrrolidin-3-yl]urea
CID 95312527
1-[(1-phenylpyrrolidin-3-yl)methyl]pyrrolidine-3-carboxamide
CID 127267019
carbamic acid;1-phenylpiperidine
CID 161473217
[(3S)-1-phenylpyrrolidin-3-yl]methanol
CID 42258987

Frequently Asked Questions

What is the IUPAC name of 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide?
The IUPAC name of 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide (CID 70460540) is 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide.
What is the SMILES notation for 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide?
The canonical SMILES for 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide is NC(=O)C(C1CCN(c2ccccc2)C1)C1CCN(c2ccccc2)C1.
What is the InChIKey of 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide?
The InChIKey is AANPGNMZVSOZSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O/c23-22(26)21(17-11-13-24(15-17)19-7-3-1-4-8-19)18-12-14-25(16-18)20-9-5-2-6-10-20/h1-10,17-18,21H,11-16H2,(H2,23,26).
What are the key properties of 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide?
2,2-bis(1-phenylpyrrolidin-3-yl)acetamide has a molecular weight of 349.48 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(1-phenylpyrrolidin-3-yl)acetamide is sourced from PubChem (CID 70460540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).