(2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide

C19H20N2O3 — CID 95346618

IUPAC(2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide
SMILESCc1ccc(Oc2ccccc2CNC(=O)[C@H]2CCC(=O)N2)cc1
InChIInChI=1S/C19H20N2O3/c1-13-6-8-15(9-7-13)24-17-5-3-2-4-14(17)12-20-19(23)16-10-11-18(22)21-16/h2-9,16H,10-12H2,1H3,(H,20,23)(H,21,22)/t16-/m1/s1
InChIKeyWEEYBQLSLMQWTC-MRXNPFEDSA-N
MW324.38 g/mol
LogP2.68
Rot. Bonds5

About (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide

(2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide (PubChem CID 95346618) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide
PubChem CID95346618
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name(2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide
SMILESCc1ccc(Oc2ccccc2CNC(=O)[C@H]2CCC(=O)N2)cc1
InChIInChI=1S/C19H20N2O3/c1-13-6-8-15(9-7-13)24-17-5-3-2-4-14(17)12-20-19(23)16-10-11-18(22)21-16/h2-9,16H,10-12H2,1H3,(H,20,23)(H,21,22)/t16-/m1/s1
InChIKeyWEEYBQLSLMQWTC-MRXNPFEDSA-N
XLogP2.68
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methoxyphenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110689662
N-[[2-(4-methylphenoxy)phenyl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119320233
2-[[2-(4-methylphenoxy)phenyl]methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120976878
(2S,4S)-2-methyl-N-[[2-(4-methylphenoxy)phenyl]methyl]piperidine-4-carboxamide
CID 120631457
N-[(2-methylsulfanylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110475894
(2S)-5-oxo-N-[(2-phenoxy-3-pyridinyl)methyl]pyrrolidine-2-carboxamide
CID 25288592
N-[4-(2-methoxyphenoxy)phenyl]-5-oxopyrrolidine-2-carboxamide
CID 42889996
1-[[2-(4-methylphenoxy)phenyl]methylcarbamoyl]pyrrolidine-3-carboxylic acid
CID 122001134
N-[(4,5-dimethoxy-2-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110794314
(2R)-N-[2-(4-ethoxyphenoxy)phenyl]-5-oxopyrrolidine-2-carboxamide
CID 39971968
2-amino-N-[[2-(4-methylphenoxy)phenyl]methyl]-2-(oxan-4-yl)acetamide
CID 120792516
2-methyl-3-(methylamino)-N-[[2-(4-methylphenoxy)phenyl]methyl]propanamide
CID 119777795

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide (CID 95346618) is (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide is Cc1ccc(Oc2ccccc2CNC(=O)[C@H]2CCC(=O)N2)cc1.
What is the InChIKey of (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide?
The InChIKey is WEEYBQLSLMQWTC-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-13-6-8-15(9-7-13)24-17-5-3-2-4-14(17)12-20-19(23)16-10-11-18(22)21-16/h2-9,16H,10-12H2,1H3,(H,20,23)(H,21,22)/t16-/m1/s1.
What are the key properties of (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide?
(2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[[2-(4-methylphenoxy)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 95346618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).