2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide

C14H21N3O2 — CID 154761342

IUPAC2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide
SMILESCNC(=O)C1(COC)CCCN1Cc1ccncc1
InChIInChI=1S/C14H21N3O2/c1-15-13(18)14(11-19-2)6-3-9-17(14)10-12-4-7-16-8-5-12/h4-5,7-8H,3,6,9-11H2,1-2H3,(H,15,18)
InChIKeyPMYVPEOCYFYPCZ-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.81
Rot. Bonds5

About 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide

2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide (PubChem CID 154761342) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide
PubChem CID154761342
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide
SMILESCNC(=O)C1(COC)CCCN1Cc1ccncc1
InChIInChI=1S/C14H21N3O2/c1-15-13(18)14(11-19-2)6-3-9-17(14)10-12-4-7-16-8-5-12/h4-5,7-8H,3,6,9-11H2,1-2H3,(H,15,18)
InChIKeyPMYVPEOCYFYPCZ-UHFFFAOYSA-N
XLogP0.81
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-benzyl-2-ethylpyrrolidine-2-carboxylic acid
CID 83070927
1-(cyclopent-3-ene-1-carbonyl)-2-(methoxymethyl)-N-methylpyrrolidine-2-carboxamide
CID 154796380
4-(methoxymethyl)-1-[(4-pyridin-4-ylphenyl)methyl]piperidine-4-carboxylic acid
CID 167777899
1-[[4-(dimethylamino)phenyl]methyl]-2-ethylpyrrolidine-2-carboxylic acid
CID 83080124
2-(methoxymethyl)-1-[(3-methylquinoxalin-2-yl)methyl]pyrrolidine-2-carboxylic acid
CID 167758505
3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidine-3-carboxylic acid
CID 72881029
2-(methoxymethyl)-N-methyl-1-[2-(pyridin-3-ylsulfonylamino)acetyl]pyrrolidine-2-carboxamide
CID 126825077
1-[2-(2-chloro-3-methoxyphenyl)acetyl]-2-(methoxymethyl)-N-methylpyrrolidine-2-carboxamide
CID 126825078
1-(3-chloro-5-methoxybenzoyl)-2-(methoxymethyl)-N-methylpyrrolidine-2-carboxamide
CID 154761884
1-[(3-bromo-4-methoxyphenyl)methyl]-2-ethylpyrrolidine-2-carboxylic acid
CID 83079736
2-(methoxymethyl)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidine-2-carboxylic acid
CID 154746588
1-[(3-bromo-4-fluorophenyl)methyl]-2-ethylpyrrolidine-2-carboxylic acid
CID 83080284

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide (CID 154761342) is 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide is CNC(=O)C1(COC)CCCN1Cc1ccncc1.
What is the InChIKey of 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide?
The InChIKey is PMYVPEOCYFYPCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-15-13(18)14(11-19-2)6-3-9-17(14)10-12-4-7-16-8-5-12/h4-5,7-8H,3,6,9-11H2,1-2H3,(H,15,18).
What are the key properties of 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide?
2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 0.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N-methyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 154761342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).