N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide

C14H20N2O2 — CID 60740965

IUPACN-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide
SMILESCOCc1ccccc1CNC(=O)C1CCCN1
InChIInChI=1S/C14H20N2O2/c1-18-10-12-6-3-2-5-11(12)9-16-14(17)13-7-4-8-15-13/h2-3,5-6,13,15H,4,7-10H2,1H3,(H,16,17)
InChIKeyZQCNJYVEECPOON-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.20
Rot. Bonds5

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

N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide (PubChem CID 60740965) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide
PubChem CID60740965
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide
SMILESCOCc1ccccc1CNC(=O)C1CCCN1
InChIInChI=1S/C14H20N2O2/c1-18-10-12-6-3-2-5-11(12)9-16-14(17)13-7-4-8-15-13/h2-3,5-6,13,15H,4,7-10H2,1H3,(H,16,17)
InChIKeyZQCNJYVEECPOON-UHFFFAOYSA-N
XLogP1.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-[[2-(methoxymethyl)phenyl]methyl]piperidine-2-carboxamide
CID 93359111
(2R)-N-[[2-(ethoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide
CID 103795112
N-[[2-(hydroxymethyl)phenyl]methyl]piperidine-2-carboxamide
CID 126781786
(2S)-N-[(2-bromophenyl)methyl]pyrrolidine-2-carboxamide
CID 61402429
N-[[2-(methoxymethyl)phenyl]methyl]-2-pyrrolidin-2-ylacetamide
CID 61363866
N-[[2-(diethylaminomethyl)phenyl]methyl]pyrrolidine-2-carboxamide
CID 60717846
(2S)-N-[(2-methylphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119688344
N-[2-(methoxymethyl)phenyl]azepane-2-carboxamide
CID 64563598
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
N-[[2-(methoxymethyl)phenyl]methyl]-2-methylpiperidine-4-carboxamide
CID 106739192

Frequently Asked Questions

What is the IUPAC name of N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide?
The IUPAC name of N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide (CID 60740965) is N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide is COCc1ccccc1CNC(=O)C1CCCN1.
What is the InChIKey of N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide?
The InChIKey is ZQCNJYVEECPOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-18-10-12-6-3-2-5-11(12)9-16-14(17)13-7-4-8-15-13/h2-3,5-6,13,15H,4,7-10H2,1H3,(H,16,17).
What are the key properties of N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide?
N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(methoxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 60740965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).