(2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide

C19H22N2O2 — CID 94080897

IUPAC(2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(C)c1
InChIInChI=1S/C19H22N2O2/c1-14-7-5-8-15(13-14)17-10-6-12-21(17)19(22)20-16-9-3-4-11-18(16)23-2/h3-5,7-9,11,13,17H,6,10,12H2,1-2H3,(H,20,22)/t17-/m0/s1
InChIKeyMNERYFZHHDADMV-KRWDZBQOSA-N
MW310.40 g/mol
LogP4.37
Rot. Bonds3

About (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide

(2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide (PubChem CID 94080897) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
PubChem CID94080897
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name(2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(C)c1
InChIInChI=1S/C19H22N2O2/c1-14-7-5-8-15(13-14)17-10-6-12-21(17)19(22)20-16-9-3-4-11-18(16)23-2/h3-5,7-9,11,13,17H,6,10,12H2,1-2H3,(H,20,22)/t17-/m0/s1
InChIKeyMNERYFZHHDADMV-KRWDZBQOSA-N
XLogP4.37
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(2-methoxyphenyl)-2-(3-methylphenyl)azepane-1-carboxamide
CID 93076725
(2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
CID 51855985
(2R)-2-(3-methylphenyl)-N-[2-(trifluoromethyl)phenyl]pyrrolidine-1-carboxamide
CID 94080902
(2,6-dimethoxyphenyl)-[2-(3-methylphenyl)pyrrolidin-1-yl]methanone
CID 50747261
N-(2-chlorophenyl)-2-(3-methylphenyl)azepane-1-carboxamide
CID 53013090
(2-methoxyphenyl)-[(2R)-2-(3-methylphenyl)pyrrolidin-1-yl]methanone
CID 95053415
(2S)-2-(3-methylphenyl)-N-(4-methylphenyl)pyrrolidine-1-carboxamide
CID 51856238
N-(3,5-dimethylphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
CID 50747165
(2R)-N-(2-methoxyphenyl)-2-(4-methoxyphenyl)azepane-1-carboxamide
CID 41013165
N-(3-methoxyphenyl)-2-(3-methylphenyl)azepane-1-carboxamide
CID 53013061
2-(2,5-dimethoxyphenyl)-N-(2-methoxyphenyl)pyrrolidine-1-carboxamide
CID 51204890
(2S)-2-(4-chlorophenyl)-N-(2-methoxy-5-methylphenyl)pyrrolidine-1-carboxamide
CID 51856616

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide?
The IUPAC name of (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide (CID 94080897) is (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide?
The canonical SMILES for (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide is COc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(C)c1.
What is the InChIKey of (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide?
The InChIKey is MNERYFZHHDADMV-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-14-7-5-8-15(13-14)17-10-6-12-21(17)19(22)20-16-9-3-4-11-18(16)23-2/h3-5,7-9,11,13,17H,6,10,12H2,1-2H3,(H,20,22)/t17-/m0/s1.
What are the key properties of (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide?
(2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-methoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 94080897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).