3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide

C13H19N3O — CID 55165709

IUPAC3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NCc2ccccn2)CCNC1
InChIInChI=1S/C13H19N3O/c1-2-13(6-8-14-10-13)12(17)16-9-11-5-3-4-7-15-11/h3-5,7,14H,2,6,8-10H2,1H3,(H,16,17)
InChIKeyGEGPYZOOLIVJMP-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.09
Rot. Bonds4

About 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide

3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide (PubChem CID 55165709) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
PubChem CID55165709
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NCc2ccccn2)CCNC1
InChIInChI=1S/C13H19N3O/c1-2-13(6-8-14-10-13)12(17)16-9-11-5-3-4-7-15-11/h3-5,7,14H,2,6,8-10H2,1H3,(H,16,17)
InChIKeyGEGPYZOOLIVJMP-UHFFFAOYSA-N
XLogP1.09
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 55176838
4-(methoxymethyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;dihydrochloride
CID 120615837
N-[(2-bromophenyl)methyl]-3-ethylpyrrolidine-3-carboxamide
CID 63141717
3-propyl-N-(pyridazin-3-ylmethyl)pyrrolidine-3-carboxamide
CID 106896186
3-ethyl-N-(furan-2-ylmethyl)pyrrolidine-3-carboxamide
CID 63140952
1-amino-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
CID 24708548
3-ethyl-N-(1H-pyrrol-3-ylmethyl)pyrrolidine-3-carboxamide
CID 106384775
3-ethyl-N-[(3-fluorophenyl)methyl]pyrrolidine-3-carboxamide
CID 55165134
3-ethyl-N-[[4-(methylcarbamoyl)phenyl]methyl]pyrrolidine-3-carboxamide
CID 63141479
3-ethyl-N-[[3-(hydroxymethyl)phenyl]methyl]piperidine-3-carboxamide
CID 107218375
3-ethyl-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
CID 81407453
1-phenyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 30944923

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide (CID 55165709) is 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide is CCC1(C(=O)NCc2ccccn2)CCNC1.
What is the InChIKey of 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide?
The InChIKey is GEGPYZOOLIVJMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-2-13(6-8-14-10-13)12(17)16-9-11-5-3-4-7-15-11/h3-5,7,14H,2,6,8-10H2,1H3,(H,16,17).
What are the key properties of 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide?
3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 55165709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).