2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide

C23H30N2O3 — CID 86943343

IUPAC2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide
SMILESCOc1cccc(CC(C)NC(=O)N2CCCC2Cc2ccccc2OC)c1
InChIInChI=1S/C23H30N2O3/c1-17(14-18-8-6-11-21(15-18)27-2)24-23(26)25-13-7-10-20(25)16-19-9-4-5-12-22(19)28-3/h4-6,8-9,11-12,15,17,20H,7,10,13-14,16H2,1-3H3,(H,24,26)
InChIKeyQQQLQQUZQVASJY-UHFFFAOYSA-N
MW382.50 g/mol
LogP4.05
Rot. Bonds7

About 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide

2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide (PubChem CID 86943343) has the molecular formula C23H30N2O3 and a molecular weight of 382.50 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide
PubChem CID86943343
Molecular FormulaC23H30N2O3
Molecular Weight382.50 g/mol
Exact Mass382.23
IUPAC Name2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide
SMILESCOc1cccc(CC(C)NC(=O)N2CCCC2Cc2ccccc2OC)c1
InChIInChI=1S/C23H30N2O3/c1-17(14-18-8-6-11-21(15-18)27-2)24-23(26)25-13-7-10-20(25)16-19-9-4-5-12-22(19)28-3/h4-6,8-9,11-12,15,17,20H,7,10,13-14,16H2,1-3H3,(H,24,26)
InChIKeyQQQLQQUZQVASJY-UHFFFAOYSA-N
XLogP4.05
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.50
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide 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-(hydroxymethyl)-N-[1-(2-methoxyphenyl)-3-methylbutan-2-yl]pyrrolidine-1-carboxamide
CID 111631491
4-(1-hydroxyethyl)-N-[1-(3-methoxyphenyl)propan-2-yl]piperidine-1-carboxamide
CID 111438806
4-(hydroxymethyl)-N-[1-(3-methoxyphenyl)propan-2-yl]piperidine-1-carboxamide
CID 111122302
4-[[2-[(2-methoxyphenyl)methyl]pyrrolidine-1-carbonyl]amino]butanoic acid
CID 122021378
N-[1-(3-methoxyphenyl)propan-2-yl]-4-[2-(2-methylphenyl)acetyl]piperazine-1-carboxamide
CID 86943270
2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide
CID 96532447
1-(1-phenylpropan-2-ylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 63010608
2-(2-methoxyanilino)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide
CID 96534561
tert-butyl (2S)-2-[(2-methoxyphenyl)methyl]pyrrolidine-1-carboxylate
CID 50905252
(2R)-N-(3-acetylphenyl)-2-[(3-methoxyphenyl)methyl]pyrrolidine-1-carboxamide
CID 96998424
2-amino-3-methoxy-1-[2-[(2-methoxyphenyl)methyl]pyrrolidin-1-yl]propan-1-one
CID 120987971
1-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-1,4-dicarboxamide
CID 56798078

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide?
The IUPAC name of 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide (CID 86943343) is 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide.
What is the SMILES notation for 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide?
The canonical SMILES for 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide is COc1cccc(CC(C)NC(=O)N2CCCC2Cc2ccccc2OC)c1.
What is the InChIKey of 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide?
The InChIKey is QQQLQQUZQVASJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O3/c1-17(14-18-8-6-11-21(15-18)27-2)24-23(26)25-13-7-10-20(25)16-19-9-4-5-12-22(19)28-3/h4-6,8-9,11-12,15,17,20H,7,10,13-14,16H2,1-3H3,(H,24,26).
What are the key properties of 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide?
2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide has a molecular weight of 382.50 g/mol, XLogP of 4.05, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methyl]-N-[1-(3-methoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 86943343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).