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

C19H24N4O — CID 53185930

IUPACN-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
SMILESO=C(CCc1ccnc(N2CCCC2)c1)NCCc1ccncc1
InChIInChI=1S/C19H24N4O/c24-19(22-12-7-16-5-9-20-10-6-16)4-3-17-8-11-21-18(15-17)23-13-1-2-14-23/h5-6,8-11,15H,1-4,7,12-14H2,(H,22,24)
InChIKeyWUBHMLSSKOSXJX-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.37
Rot. Bonds7

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

N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide (PubChem CID 53185930) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide.

Molecular Properties

Compound NameN-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
PubChem CID53185930
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC NameN-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
SMILESO=C(CCc1ccnc(N2CCCC2)c1)NCCc1ccncc1
InChIInChI=1S/C19H24N4O/c24-19(22-12-7-16-5-9-20-10-6-16)4-3-17-8-11-21-18(15-17)23-13-1-2-14-23/h5-6,8-11,15H,1-4,7,12-14H2,(H,22,24)
InChIKeyWUBHMLSSKOSXJX-UHFFFAOYSA-N
XLogP2.37
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-pyrrolidin-1-yl-4-pyridinyl)-N-(2-thiophen-2-ylethyl)propanamide
CID 53185937
N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 83273482
N-[2-(dimethylamino)ethyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 53185944
3-(2-pyrrolidin-1-yl-4-pyridinyl)propanoic acid
CID 82661762
N-pentan-3-yl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 83273250
3-amino-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]propanamide
CID 119841583
N-[(2-methoxyphenyl)methyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 53185909
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
1-[2-(3-fluorophenyl)ethyl]-3-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]urea
CID 36962409
N-[[2-(azepan-1-yl)-4-pyridinyl]methyl]-3-(1,3-thiazol-4-yl)propanamide
CID 75370015
3-(3-amino-4-pyrrolidin-1-ylphenyl)-N-(pyridin-4-ylmethyl)propanamide
CID 39112705

Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
The IUPAC name of N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide (CID 53185930) is N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide.
What is the SMILES notation for N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
The canonical SMILES for N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide is O=C(CCc1ccnc(N2CCCC2)c1)NCCc1ccncc1.
What is the InChIKey of N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
The InChIKey is WUBHMLSSKOSXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c24-19(22-12-7-16-5-9-20-10-6-16)4-3-17-8-11-21-18(15-17)23-13-1-2-14-23/h5-6,8-11,15H,1-4,7,12-14H2,(H,22,24).
What are the key properties of N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide?
N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide has a molecular weight of 324.43 g/mol, XLogP of 2.37, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-4-ylethyl)-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide is sourced from PubChem (CID 53185930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).