7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one

C9H12N2O — CID 123436322

IUPAC7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
SMILESCCC1CNC(=O)c2cc[nH]c21
InChIInChI=1S/C9H12N2O/c1-2-6-5-11-9(12)7-3-4-10-8(6)7/h3-4,6,10H,2,5H2,1H3,(H,11,12)
InChIKeyVIUPGFXKTFCJDL-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.25
Rot. Bonds1

About 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one

7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one (PubChem CID 123436322) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
PubChem CID123436322
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
SMILESCCC1CNC(=O)c2cc[nH]c21
InChIInChI=1S/C9H12N2O/c1-2-6-5-11-9(12)7-3-4-10-8(6)7/h3-4,6,10H,2,5H2,1H3,(H,11,12)
InChIKeyVIUPGFXKTFCJDL-UHFFFAOYSA-N
XLogP1.25
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

7-propyl-1,5,6,7-tetrahydropyrrolo[3,2-c]azepine-4,8-dione
CID 67943123
(7S)-7-ethyl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
CID 11536428
4-ethyl-7-fluoro-3,4-dihydro-2H-isoquinolin-1-one
CID 82125678
(4S)-4-ethyl-7-propan-2-yl-3,4-dihydro-2H-isoquinolin-1-one
CID 59191690
7-(2-chloro-4-pyridinyl)-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
CID 87958660
4-butyl-3,4-dihydro-2H-isoquinolin-1-one
CID 54043553
6-methyl-1,5,6,7-tetrahydropyrrolo[2,3-c]azepine-4,8-dione
CID 68639083
3,6-diethyl-2,3-dihydro-1H-quinolin-4-one
CID 142549249
(5R)-5-ethylpiperidine-2,4-dione
CID 86318642
7-phenyl-4-propyl-3,4-dihydro-2H-isoquinolin-1-one
CID 82133749
spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one
CID 175842879
9-ethyl-1,5,6,7,8,9-hexahydropyrido[2,3-d]azepin-2-one;dihydrobromide
CID 68876103

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one?
The IUPAC name of 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one (CID 123436322) is 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one.
What is the SMILES notation for 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one?
The canonical SMILES for 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one is CCC1CNC(=O)c2cc[nH]c21.
What is the InChIKey of 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one?
The InChIKey is VIUPGFXKTFCJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-2-6-5-11-9(12)7-3-4-10-8(6)7/h3-4,6,10H,2,5H2,1H3,(H,11,12).
What are the key properties of 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one?
7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one has a molecular weight of 164.21 g/mol, XLogP of 1.25, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one is sourced from PubChem (CID 123436322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).