N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide

C15H22N2O2 — CID 63005308

IUPACN-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide
SMILESCCOc1ccccc1CN(C)C(=O)C1CCNC1
InChIInChI=1S/C15H22N2O2/c1-3-19-14-7-5-4-6-13(14)11-17(2)15(18)12-8-9-16-10-12/h4-7,12,16H,3,8-11H2,1-2H3
InChIKeyUDKDUEMEZQCFMG-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.65
Rot. Bonds5

About N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide

N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide (PubChem CID 63005308) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide
PubChem CID63005308
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide
SMILESCCOc1ccccc1CN(C)C(=O)C1CCNC1
InChIInChI=1S/C15H22N2O2/c1-3-19-14-7-5-4-6-13(14)11-17(2)15(18)12-8-9-16-10-12/h4-7,12,16H,3,8-11H2,1-2H3
InChIKeyUDKDUEMEZQCFMG-UHFFFAOYSA-N
XLogP1.65
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 ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-methyl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-3-carboxamide
CID 124685958
N-methyl-N-[[2-(2-methylpropoxy)phenyl]methyl]piperidine-4-carboxamide
CID 50961416
(2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 103809566
(3S)-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 81128624
N-methyl-N-(naphthalen-1-ylmethyl)pyrrolidine-3-carboxamide
CID 115159561
(3S)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]pyrrolidine-3-carboxamide
CID 124685812
(3R)-N-[2-(2-methoxyphenyl)ethyl]-N-methylpyrrolidine-3-carboxamide
CID 124685580
3-amino-N-[(2-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide;hydrochloride
CID 119738433
N-methyl-N-[(2-nitrophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119723179
N-[2-(2-ethoxyphenyl)ethyl]pyrrolidine-3-carboxamide
CID 119772912
N-[(2-ethoxyphenyl)methyl]-N-methyl-3-piperidin-3-ylbutanamide
CID 119738443
N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide
CID 106739545

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide (CID 63005308) is N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide is CCOc1ccccc1CN(C)C(=O)C1CCNC1.
What is the InChIKey of N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide?
The InChIKey is UDKDUEMEZQCFMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-19-14-7-5-4-6-13(14)11-17(2)15(18)12-8-9-16-10-12/h4-7,12,16H,3,8-11H2,1-2H3.
What are the key properties of N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide?
N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63005308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).