2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide

C15H22N2O2 — CID 141285069

IUPAC2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide
SMILESCOCC1(C(N)=O)CCCN1[C@@H](C)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-12(13-7-4-3-5-8-13)17-10-6-9-15(17,11-19-2)14(16)18/h3-5,7-8,12H,6,9-11H2,1-2H3,(H2,16,18)/t12-,15?/m0/s1
InChIKeyWRYKXOXMSSRLNT-SFVWDYPZSA-N
MW262.35 g/mol
LogP1.71
Rot. Bonds5

About 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide

2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide (PubChem CID 141285069) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide
PubChem CID141285069
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide
SMILESCOCC1(C(N)=O)CCCN1[C@@H](C)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-12(13-7-4-3-5-8-13)17-10-6-9-15(17,11-19-2)14(16)18/h3-5,7-8,12H,6,9-11H2,1-2H3,(H2,16,18)/t12-,15?/m0/s1
InChIKeyWRYKXOXMSSRLNT-SFVWDYPZSA-N
XLogP1.71
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-1-(1-phenylethyl)pyrrolidine-2-carboxylic acid
CID 83080387
(2R)-2-benzyl-1-(2-methylpropanoyl)pyrrolidine-2-carboxamide
CID 159272717
2-ethyl-1-[1-(4-fluorophenyl)ethyl]pyrrolidine-2-carboxylic acid
CID 83080564
2-ethyl-1-[1-(3-fluorophenyl)ethyl]pyrrolidine-2-carboxylic acid
CID 83080388
[1-(methoxymethyl)cyclopropyl]methyl 3-(1-phenylethyl)imidazole-4-carboxylate
CID 174880490
1-[2-(2,6-dimethylphenoxy)ethyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide
CID 154742987
(1-hydroxycyclobutyl)methyl 3-(1-phenylethyl)imidazole-4-carboxylate
CID 155373640
2-diethoxyphosphoryl-2-methyl-1-[(1R)-1-phenylethyl]pyrrolidine
CID 102449171
[(2R)-2-methyl-1-(1-phenylethyl)piperidin-2-yl]methyl trifluoromethanesulfonate
CID 139769243
2-methyl-1-(1-pyridin-4-ylethyl)pyrrolidine-2-carboxylic acid
CID 65070819
1-[1-(4-methoxyphenyl)ethyl]-2-methylpyrrolidine-2-carboxylic acid
CID 65071128
dimethyl 2,5-dimethyl-1-[(1S)-1-phenylethyl]pyrrolidine-2,5-dicarboxylate
CID 10615591

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide?
The IUPAC name of 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide (CID 141285069) is 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide is COCC1(C(N)=O)CCCN1[C@@H](C)c1ccccc1.
What is the InChIKey of 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide?
The InChIKey is WRYKXOXMSSRLNT-SFVWDYPZSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12(13-7-4-3-5-8-13)17-10-6-9-15(17,11-19-2)14(16)18/h3-5,7-8,12H,6,9-11H2,1-2H3,(H2,16,18)/t12-,15?/m0/s1.
What are the key properties of 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide?
2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 141285069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).