(2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide

C15H22N2O2 — CID 103795112

IUPAC(2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide
SMILESCCOCc1ccccc1CNC(=O)[C@H]1CCCN1
InChIInChI=1S/C15H22N2O2/c1-2-19-11-13-7-4-3-6-12(13)10-17-15(18)14-8-5-9-16-14/h3-4,6-7,14,16H,2,5,8-11H2,1H3,(H,17,18)/t14-/m1/s1
InChIKeySQEHRUSFLUXMGF-CQSZACIVSA-N
MW262.35 g/mol
LogP1.59
Rot. Bonds6

About (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide

(2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide (PubChem CID 103795112) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide
PubChem CID103795112
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name(2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide
SMILESCCOCc1ccccc1CNC(=O)[C@H]1CCCN1
InChIInChI=1S/C15H22N2O2/c1-2-19-11-13-7-4-3-6-12(13)10-17-15(18)14-8-5-9-16-14/h3-4,6-7,14,16H,2,5,8-11H2,1H3,(H,17,18)/t14-/m1/s1
InChIKeySQEHRUSFLUXMGF-CQSZACIVSA-N
XLogP1.59
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide
CID 60740965
(2S)-N-[[2-(methoxymethyl)phenyl]methyl]piperidine-2-carboxamide
CID 93359111
(2S)-N-[(2-bromophenyl)methyl]pyrrolidine-2-carboxamide
CID 61402429
N-[[2-(diethylaminomethyl)phenyl]methyl]pyrrolidine-2-carboxamide
CID 60717846
N-[[2-(hydroxymethyl)phenyl]methyl]piperidine-2-carboxamide
CID 126781786
(2S)-N-[(2-methylphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119688344
N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]pyrrolidine-2-carboxamide
CID 119836618
N-[(2-propan-2-yloxyphenyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119280684
N-[[2-[[cyclohexyl(methyl)amino]methyl]phenyl]methyl]pyrrolidine-2-carboxamide
CID 119861656
(2S)-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-2-carboxamide
CID 61253216
(2S)-N-[[2-(difluoromethoxy)phenyl]methyl]pyrrolidine-2-carboxamide
CID 61252076
(2R)-N-(naphthalen-1-ylmethyl)piperidine-2-carboxamide
CID 103808745

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide (CID 103795112) is (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide is CCOCc1ccccc1CNC(=O)[C@H]1CCCN1.
What is the InChIKey of (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide?
The InChIKey is SQEHRUSFLUXMGF-CQSZACIVSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-19-11-13-7-4-3-6-12(13)10-17-15(18)14-8-5-9-16-14/h3-4,6-7,14,16H,2,5,8-11H2,1H3,(H,17,18)/t14-/m1/s1.
What are the key properties of (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide?
(2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 103795112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).