6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one

C19H20N4O2 — CID 53164602

IUPAC6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one
SMILESO=C(Cn1ccc2ccn(Cc3cccnc3)c2c1=O)N1CCCC1
InChIInChI=1S/C19H20N4O2/c24-17(21-8-1-2-9-21)14-23-11-6-16-5-10-22(18(16)19(23)25)13-15-4-3-7-20-12-15/h3-7,10-12H,1-2,8-9,13-14H2
InChIKeyHWLOVAUTBQLAIH-UHFFFAOYSA-N
MW336.39 g/mol
LogP1.87
Rot. Bonds4

About 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one

6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one (PubChem CID 53164602) has the molecular formula C19H20N4O2 and a molecular weight of 336.39 g/mol. Its IUPAC name is 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one.

Molecular Properties

Compound Name6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one
PubChem CID53164602
Molecular FormulaC19H20N4O2
Molecular Weight336.39 g/mol
Exact Mass336.16
IUPAC Name6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one
SMILESO=C(Cn1ccc2ccn(Cc3cccnc3)c2c1=O)N1CCCC1
InChIInChI=1S/C19H20N4O2/c24-17(21-8-1-2-9-21)14-23-11-6-16-5-10-22(18(16)19(23)25)13-15-4-3-7-20-12-15/h3-7,10-12H,1-2,8-9,13-14H2
InChIKeyHWLOVAUTBQLAIH-UHFFFAOYSA-N
XLogP1.87
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-(oxolan-2-ylmethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one
CID 53164579
1-[2-oxo-2-[(3R)-3-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]ethyl]pyrimidin-2-one
CID 97210136
3-oxo-N-(pyridin-3-ylmethyl)-3-pyrrolidin-1-ylpropanamide
CID 108941959
2-indol-1-yl-1-pyrrolidin-1-ylethanone
CID 5191246
2-(2-ethylimidazol-1-yl)-1-[(3R)-3-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]ethanone
CID 97208620
2-[(3S)-3-(pyridin-3-ylmethyl)piperidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 124995664
N,N-diethyl-6-oxo-1-[2-oxo-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]ethyl]pyridine-3-sulfonamide
CID 55483121
(3S)-3-[2-(azocan-1-yl)-2-oxoethyl]-3-phenyl-1-(pyridin-3-ylmethyl)pyrrolidine-2,5-dione
CID 42165590
5,5-dimethyl-3-[2-oxo-2-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]ethyl]imidazolidine-2,4-dione
CID 70760964
1-[2-oxo-2-[3-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]ethyl]imidazolidine-2,4-dione
CID 72874449
3-[2-oxo-2-[3-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one
CID 72926625
3-bromo-1-(2-oxo-2-piperidin-1-ylethyl)pyridin-2-one
CID 114760810

Frequently Asked Questions

What is the IUPAC name of 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one?
The IUPAC name of 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one (CID 53164602) is 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one.
What is the SMILES notation for 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one?
The canonical SMILES for 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one is O=C(Cn1ccc2ccn(Cc3cccnc3)c2c1=O)N1CCCC1.
What is the InChIKey of 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one?
The InChIKey is HWLOVAUTBQLAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c24-17(21-8-1-2-9-21)14-23-11-6-16-5-10-22(18(16)19(23)25)13-15-4-3-7-20-12-15/h3-7,10-12H,1-2,8-9,13-14H2.
What are the key properties of 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one?
6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one has a molecular weight of 336.39 g/mol, XLogP of 1.87, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-oxo-2-pyrrolidin-1-ylethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one is sourced from PubChem (CID 53164602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).