N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide

C15H22N2O2 — CID 60738708

IUPACN-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide
SMILESCCN(Cc1ccc(OC)cc1)C(=O)C1CCCN1
InChIInChI=1S/C15H22N2O2/c1-3-17(15(18)14-5-4-10-16-14)11-12-6-8-13(19-2)9-7-12/h6-9,14,16H,3-5,10-11H2,1-2H3
InChIKeyFYFKCWMJUJTMJK-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.80
Rot. Bonds5

About N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide

N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide (PubChem CID 60738708) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide
PubChem CID60738708
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide
SMILESCCN(Cc1ccc(OC)cc1)C(=O)C1CCCN1
InChIInChI=1S/C15H22N2O2/c1-3-17(15(18)14-5-4-10-16-14)11-12-6-8-13(19-2)9-7-12/h6-9,14,16H,3-5,10-11H2,1-2H3
InChIKeyFYFKCWMJUJTMJK-UHFFFAOYSA-N
XLogP1.80
TPSA41.57 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 ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-ethyl-N-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide
CID 93375226
N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide
CID 60710815
N-[[4-(dimethylcarbamoyl)phenyl]methyl]-N-ethylpyrrolidine-2-carboxamide;hydrochloride
CID 119318530
(2S)-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 93375227
(2S)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]piperidine-2-carboxamide
CID 103808185
N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 119272234
(2R)-N,N-diethylpyrrolidine-2-carboxamide
CID 952316
(2S)-N-(1,3-benzodioxol-5-ylmethyl)-N-ethylpiperidine-2-carboxamide
CID 103808191
N-ethyl-N-[(4-methoxyphenyl)methyl]oxane-4-carboxamide
CID 52572788
2-amino-N-ethyl-N-[(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119737162
3-amino-N-ethyl-N-[(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119737170
(2S)-N-[(5-bromothiophen-2-yl)methyl]-N-ethylpyrrolidine-2-carboxamide
CID 61164827

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide (CID 60738708) is N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide is CCN(Cc1ccc(OC)cc1)C(=O)C1CCCN1.
What is the InChIKey of N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is FYFKCWMJUJTMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-17(15(18)14-5-4-10-16-14)11-12-6-8-13(19-2)9-7-12/h6-9,14,16H,3-5,10-11H2,1-2H3.
What are the key properties of N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide?
N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 60738708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).