N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide

C14H21N3O — CID 83273482

IUPACN-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
SMILESCCNC(=O)CCc1ccnc(N2CCCC2)c1
InChIInChI=1S/C14H21N3O/c1-2-15-14(18)6-5-12-7-8-16-13(11-12)17-9-3-4-10-17/h7-8,11H,2-6,9-10H2,1H3,(H,15,18)
InChIKeyZYGBRNHMQVTFKB-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.75
Rot. Bonds5

About N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide

N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide (PubChem CID 83273482) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
PubChem CID83273482
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
SMILESCCNC(=O)CCc1ccnc(N2CCCC2)c1
InChIInChI=1S/C14H21N3O/c1-2-15-14(18)6-5-12-7-8-16-13(11-12)17-9-3-4-10-17/h7-8,11H,2-6,9-10H2,1H3,(H,15,18)
InChIKeyZYGBRNHMQVTFKB-UHFFFAOYSA-N
XLogP1.75
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 53185944
N-pentan-3-yl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 83273250
N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 53185930
3-(2-pyrrolidin-1-yl-4-pyridinyl)propanoic acid
CID 82661762
N-[(2-methoxyphenyl)methyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 53185909
3-(2-pyrrolidin-1-yl-4-pyridinyl)-N-(2-thiophen-2-ylethyl)propanamide
CID 53185937
3-amino-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]propanamide
CID 119841583
2-ethoxy-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]acetamide
CID 52557964
N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
CID 53186075
4-amino-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]butanamide;dihydrochloride
CID 119841403
N-[[2-(azepan-1-yl)-4-pyridinyl]methyl]-3-(1,3-thiazol-4-yl)propanamide
CID 75370015
3-(3-methylphenyl)-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propanamide
CID 55742598

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
The IUPAC name of N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide (CID 83273482) is N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide.
What is the SMILES notation for N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
The canonical SMILES for N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide is CCNC(=O)CCc1ccnc(N2CCCC2)c1.
What is the InChIKey of N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
The InChIKey is ZYGBRNHMQVTFKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-2-15-14(18)6-5-12-7-8-16-13(11-12)17-9-3-4-10-17/h7-8,11H,2-6,9-10H2,1H3,(H,15,18).
What are the key properties of N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide has a molecular weight of 247.34 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide is sourced from PubChem (CID 83273482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).