(2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone

C16H23N3O — CID 63166896

IUPAC(2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone
SMILESN[C@@H](C(=O)N1CCC(N2CCCC2)C1)c1ccccc1
InChIInChI=1S/C16H23N3O/c17-15(13-6-2-1-3-7-13)16(20)19-11-8-14(12-19)18-9-4-5-10-18/h1-3,6-7,14-15H,4-5,8-12,17H2/t14?,15-/m1/s1
InChIKeyCXPFFGZJDHIUPS-YSSOQSIOSA-N
MW273.38 g/mol
LogP1.38
Rot. Bonds3

About (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone

(2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone (PubChem CID 63166896) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone.

Molecular Properties

Compound Name(2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone
PubChem CID63166896
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name(2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone
SMILESN[C@@H](C(=O)N1CCC(N2CCCC2)C1)c1ccccc1
InChIInChI=1S/C16H23N3O/c17-15(13-6-2-1-3-7-13)16(20)19-11-8-14(12-19)18-9-4-5-10-18/h1-3,6-7,14-15H,4-5,8-12,17H2/t14?,15-/m1/s1
InChIKeyCXPFFGZJDHIUPS-YSSOQSIOSA-N
XLogP1.38
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpiperidin-1-yl)ethanone;dihydrochloride
CID 119858252
2-amino-2-phenyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone;dihydrochloride
CID 119843387
(2S)-2-amino-1-[(3R)-3-(4-ethylpiperazin-1-yl)pyrrolidin-1-yl]-2-phenylethanone
CID 99852464
2-amino-3-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-1-one
CID 63166900
(2S)-1-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-2-amino-2-phenylethanone
CID 104897194
(2R)-1-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-2-amino-2-phenylethanone
CID 61156147
2-amino-2-phenyl-1-(3-phenylpyrrolidin-1-yl)ethanone;hydrochloride
CID 119290269
2-amino-2-phenyl-1-pyrrolidin-1-ylethanone
CID 24693981
2-amino-1-(3,4-dimethylpiperidin-1-yl)-2-phenylethanone
CID 86784489
(2S)-2-amino-1-(azocan-1-yl)-2-phenylethanone
CID 28801220
2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone
CID 119278410
1-(2-amino-2-phenylacetyl)piperidine-4-carboxamide
CID 24695590

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone?
The IUPAC name of (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone (CID 63166896) is (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone.
What is the SMILES notation for (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone?
The canonical SMILES for (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone is N[C@@H](C(=O)N1CCC(N2CCCC2)C1)c1ccccc1.
What is the InChIKey of (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone?
The InChIKey is CXPFFGZJDHIUPS-YSSOQSIOSA-N. The full InChI is InChI=1S/C16H23N3O/c17-15(13-6-2-1-3-7-13)16(20)19-11-8-14(12-19)18-9-4-5-10-18/h1-3,6-7,14-15H,4-5,8-12,17H2/t14?,15-/m1/s1.
What are the key properties of (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone?
(2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone has a molecular weight of 273.38 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-phenyl-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone is sourced from PubChem (CID 63166896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).