2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide

C24H30N2O3 — CID 95592178

IUPAC2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide
SMILESCC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CCNC(=O)c1ccccc1OC
InChIInChI=1S/C24H30N2O3/c1-3-19(18-10-5-4-6-11-18)21-13-9-17-26(21)23(27)15-16-25-24(28)20-12-7-8-14-22(20)29-2/h4-8,10-12,14,19,21H,3,9,13,15-17H2,1-2H3,(H,25,28)/t19-,21-/m1/s1
InChIKeyJQHRYHDBKXURCL-TZIWHRDSSA-N
MW394.52 g/mol
LogP4.00
Rot. Bonds8

About 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide

2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide (PubChem CID 95592178) has the molecular formula C24H30N2O3 and a molecular weight of 394.52 g/mol. Its IUPAC name is 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide
PubChem CID95592178
Molecular FormulaC24H30N2O3
Molecular Weight394.52 g/mol
Exact Mass394.23
IUPAC Name2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide
SMILESCC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CCNC(=O)c1ccccc1OC
InChIInChI=1S/C24H30N2O3/c1-3-19(18-10-5-4-6-11-18)21-13-9-17-26(21)23(27)15-16-25-24(28)20-12-7-8-14-22(20)29-2/h4-8,10-12,14,19,21H,3,9,13,15-17H2,1-2H3,(H,25,28)/t19-,21-/m1/s1
InChIKeyJQHRYHDBKXURCL-TZIWHRDSSA-N
XLogP4.00
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide 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

N-[3-oxo-3-[(2R)-2-[(1S)-1-phenylpropyl]pyrrolidin-1-yl]propyl]acetamide
CID 95592185
N-[4-oxo-4-[(2S)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]butyl]benzamide
CID 95592208
3-(2-methoxyethoxy)-1-[(2R)-2-[(1S)-1-phenylpropyl]pyrrolidin-1-yl]propan-1-one
CID 95300829
2-methoxy-N-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]benzamide
CID 24818354
4-amino-3-methoxy-1-[2-(1-phenylpropyl)pyrrolidin-1-yl]butan-1-one
CID 120590724
4-ethoxy-N-[2-oxo-2-[2-(1-phenylpropyl)pyrrolidin-1-yl]ethyl]benzamide
CID 56800435
2-methoxy-N-[2-oxo-2-(2-phenylpyrrolidin-1-yl)ethyl]benzamide
CID 42932893
3-[(2-methoxybenzoyl)amino]propanoic acid
CID 67981005
3-(3,4-difluorophenyl)-1-[2-(1-phenylpropyl)pyrrolidin-1-yl]propan-1-one
CID 56800411
(3-methoxyphenyl)-[(2S)-2-[(1S)-1-phenylpropyl]pyrrolidin-1-yl]methanone
CID 95592187
N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide
CID 62665285
N-[2-(cycloheptylamino)ethyl]-2-methoxybenzamide
CID 81487134

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide?
The IUPAC name of 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide (CID 95592178) is 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide?
The canonical SMILES for 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide is CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CCNC(=O)c1ccccc1OC.
What is the InChIKey of 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide?
The InChIKey is JQHRYHDBKXURCL-TZIWHRDSSA-N. The full InChI is InChI=1S/C24H30N2O3/c1-3-19(18-10-5-4-6-11-18)21-13-9-17-26(21)23(27)15-16-25-24(28)20-12-7-8-14-22(20)29-2/h4-8,10-12,14,19,21H,3,9,13,15-17H2,1-2H3,(H,25,28)/t19-,21-/m1/s1.
What are the key properties of 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide?
2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide has a molecular weight of 394.52 g/mol, XLogP of 4.00, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[3-oxo-3-[(2R)-2-[(1R)-1-phenylpropyl]pyrrolidin-1-yl]propyl]benzamide is sourced from PubChem (CID 95592178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).