2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide

C27H30N2O2 — CID 11567829

IUPAC2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide
SMILESC[C@H](c1ccccc1)N1CCC(CNC(=O)C(O)(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C27H30N2O2/c1-21(23-11-5-2-6-12-23)29-18-17-22(20-29)19-28-26(30)27(31,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,21-22,31H,17-20H2,1H3,(H,28,30)/t21-,22?/m1/s1
InChIKeyBDXHGHDIEJLHAT-ZMFCMNQTSA-N
MW414.55 g/mol
LogP4.12
Rot. Bonds7

About 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide

2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide (PubChem CID 11567829) has the molecular formula C27H30N2O2 and a molecular weight of 414.55 g/mol. Its IUPAC name is 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide.

Molecular Properties

Compound Name2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide
PubChem CID11567829
Molecular FormulaC27H30N2O2
Molecular Weight414.55 g/mol
Exact Mass414.23
IUPAC Name2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide
SMILESC[C@H](c1ccccc1)N1CCC(CNC(=O)C(O)(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C27H30N2O2/c1-21(23-11-5-2-6-12-23)29-18-17-22(20-29)19-28-26(30)27(31,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,21-22,31H,17-20H2,1H3,(H,28,30)/t21-,22?/m1/s1
InChIKeyBDXHGHDIEJLHAT-ZMFCMNQTSA-N
XLogP4.12
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.55
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide 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

(2S)-2-amino-4-methyl-N-[[1-(1-phenylethyl)pyrrolidin-3-yl]methyl]pentanamide
CID 118427405
2-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methoxy]acetic acid
CID 18396255
[(3R)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]methanamine
CID 2237132
2-hydroxy-2,2-diphenyl-N-(piperidin-4-ylmethyl)acetamide
CID 10403987
(2R)-2-[ethyl(methyl)amino]-2-phenyl-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]acetamide
CID 124811415
N-methyl-1-[1-(1-phenylethyl)piperidin-3-yl]methanamine;hydrochloride
CID 119914413
1-benzhydryl-3-[(1-benzhydrylpyrrolidin-3-yl)methyl]urea
CID 11294480
2-amino-2-phenyl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide
CID 119866660
2-methyl-N-[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]propanamide
CID 94197653
2-methyl-N-[1-(1-phenylethyl)pyrrolidin-3-yl]propanamide
CID 47070507
N-[(3S)-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]propanamide
CID 98726634
N-methyl-1-[1-[1-(3-methylphenyl)ethyl]pyrrolidin-3-yl]methanamine;hydrochloride
CID 119922236

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide?
The IUPAC name of 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide (CID 11567829) is 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide.
What is the SMILES notation for 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide?
The canonical SMILES for 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide is C[C@H](c1ccccc1)N1CCC(CNC(=O)C(O)(c2ccccc2)c2ccccc2)C1.
What is the InChIKey of 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide?
The InChIKey is BDXHGHDIEJLHAT-ZMFCMNQTSA-N. The full InChI is InChI=1S/C27H30N2O2/c1-21(23-11-5-2-6-12-23)29-18-17-22(20-29)19-28-26(30)27(31,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,21-22,31H,17-20H2,1H3,(H,28,30)/t21-,22?/m1/s1.
What are the key properties of 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide?
2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide has a molecular weight of 414.55 g/mol, XLogP of 4.12, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2,2-diphenyl-N-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methyl]acetamide is sourced from PubChem (CID 11567829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).