3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one

C13H13N3O — CID 114988376

IUPAC3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one
SMILESCCNC1C(=O)Nc2c1ccc1cccnc21
InChIInChI=1S/C13H13N3O/c1-2-14-12-9-6-5-8-4-3-7-15-10(8)11(9)16-13(12)17/h3-7,12,14H,2H2,1H3,(H,16,17)
InChIKeyVEZKQWZYLJFTSC-UHFFFAOYSA-N
MW227.27 g/mol
LogP1.84
Rot. Bonds2

About 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one

3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one (PubChem CID 114988376) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one.

Molecular Properties

Compound Name3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one
PubChem CID114988376
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC Name3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one
SMILESCCNC1C(=O)Nc2c1ccc1cccnc21
InChIInChI=1S/C13H13N3O/c1-2-14-12-9-6-5-8-4-3-7-15-10(8)11(9)16-13(12)17/h3-7,12,14H,2H2,1H3,(H,16,17)
InChIKeyVEZKQWZYLJFTSC-UHFFFAOYSA-N
XLogP1.84
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(methylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one
CID 114988001
6-fluoro-3-(quinolin-8-ylamino)-1,3-dihydroindol-2-one
CID 43823553
3-(quinolin-8-ylmethylamino)pyrrolidine-2,5-dione
CID 81426474
N-[(2-quinolin-8-ylcyclopropyl)methyl]ethanamine
CID 63973584
N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine
CID 81223017
diiodo(dimethyl)stannane;1,10-phenanthroline
CID 4611650
4-propylimino-5-quinolin-8-ylimidazolidin-2-one
CID 140604914
[4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone
CID 62851096
2-methyl-1,2-dihydropyrido[3,2-h]quinazoline
CID 126746624
7-N-ethylquinoline-7,8-diamine
CID 15023104
7-propylquinolin-8-ol
CID 11604513
bis(1,10-phenanthroline);ruthenium
CID 15001085

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one?
The IUPAC name of 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one (CID 114988376) is 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one.
What is the SMILES notation for 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one?
The canonical SMILES for 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one is CCNC1C(=O)Nc2c1ccc1cccnc21.
What is the InChIKey of 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one?
The InChIKey is VEZKQWZYLJFTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-2-14-12-9-6-5-8-4-3-7-15-10(8)11(9)16-13(12)17/h3-7,12,14H,2H2,1H3,(H,16,17).
What are the key properties of 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one?
3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one has a molecular weight of 227.27 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-1,3-dihydropyrrolo[3,2-h]quinolin-2-one is sourced from PubChem (CID 114988376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).