(2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide

C20H24N2O3 — CID 51855985

IUPAC(2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
SMILESCOc1cc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2)cc(OC)c1
InChIInChI=1S/C20H24N2O3/c1-14-6-4-7-15(10-14)19-8-5-9-22(19)20(23)21-16-11-17(24-2)13-18(12-16)25-3/h4,6-7,10-13,19H,5,8-9H2,1-3H3,(H,21,23)/t19-/m1/s1
InChIKeyCIMYFVMWMQREMV-LJQANCHMSA-N
MW340.42 g/mol
LogP4.38
Rot. Bonds4

About (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide

(2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide (PubChem CID 51855985) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
PubChem CID51855985
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name(2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
SMILESCOc1cc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2)cc(OC)c1
InChIInChI=1S/C20H24N2O3/c1-14-6-4-7-15(10-14)19-8-5-9-22(19)20(23)21-16-11-17(24-2)13-18(12-16)25-3/h4,6-7,10-13,19H,5,8-9H2,1-3H3,(H,21,23)/t19-/m1/s1
InChIKeyCIMYFVMWMQREMV-LJQANCHMSA-N
XLogP4.38
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methoxyphenyl)-2-(3-methylphenyl)azepane-1-carboxamide
CID 53013061
N-(3,5-dimethylphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
CID 50747165
(2S)-2-(3-methylphenyl)-N-(4-methylphenyl)pyrrolidine-1-carboxamide
CID 51856238
(2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
CID 94080897
(2R)-2-(4-chlorophenyl)-N-(3,5-dimethoxyphenyl)pyrrolidine-1-carboxamide
CID 51856535
(2R)-N-(2-methoxyphenyl)-2-(3-methylphenyl)azepane-1-carboxamide
CID 93076725
N-(3-bromophenyl)-2-(3-methoxyphenyl)pyrrolidine-1-carboxamide
CID 86986361
N-(3-fluoro-4-methylphenyl)-2-(3-methoxyphenyl)pyrrolidine-1-carboxamide
CID 86987034
(2,6-dimethoxyphenyl)-[2-(3-methylphenyl)pyrrolidin-1-yl]methanone
CID 50747261
N-(3,5-dimethoxyphenyl)-2-thiophen-2-ylpyrrolidine-1-carboxamide
CID 20895956
(2R)-N-(3-chloro-4-fluorophenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
CID 51856550
(2S)-N-(3-fluorophenyl)-2-(3-methylphenyl)azepane-1-carboxamide
CID 93076892

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide?
The IUPAC name of (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide (CID 51855985) is (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide?
The canonical SMILES for (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide is COc1cc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2)cc(OC)c1.
What is the InChIKey of (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide?
The InChIKey is CIMYFVMWMQREMV-LJQANCHMSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-14-6-4-7-15(10-14)19-8-5-9-22(19)20(23)21-16-11-17(24-2)13-18(12-16)25-3/h4,6-7,10-13,19H,5,8-9H2,1-3H3,(H,21,23)/t19-/m1/s1.
What are the key properties of (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide?
(2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide has a molecular weight of 340.42 g/mol, XLogP of 4.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 51855985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).