2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide

C16H19N3O — CID 754251

IUPAC2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide
SMILESCC(C)C(=O)Nc1c2c(nc3ccccc13)N(C)CC2
InChIInChI=1S/C16H19N3O/c1-10(2)16(20)18-14-11-6-4-5-7-13(11)17-15-12(14)8-9-19(15)3/h4-7,10H,8-9H2,1-3H3,(H,17,18,20)
InChIKeyKMMOBCXLHOOSGS-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.82
Rot. Bonds2

About 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide

2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide (PubChem CID 754251) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide
PubChem CID754251
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide
SMILESCC(C)C(=O)Nc1c2c(nc3ccccc13)N(C)CC2
InChIInChI=1S/C16H19N3O/c1-10(2)16(20)18-14-11-6-4-5-7-13(11)17-15-12(14)8-9-19(15)3/h4-7,10H,8-9H2,1-3H3,(H,17,18,20)
InChIKeyKMMOBCXLHOOSGS-UHFFFAOYSA-N
XLogP2.82
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Importazole
CID 2949965
1-(2-Methylphenyl)-4-methylamino-6-methyl-2,3-dihydropyrrolo(3,2-c)quinoline
CID 3081211
N-[5-(2,3-dimethylphenyl)-1,2,3,4-tetrahydro-1,6-naphthyridin-7-yl]acetamide
CID 146018719
1-[2-(Dimethylamino)quinolin-4-yl]-3-phenylurea
CID 2824465
1-(2-(Diethylamino)quinazolin-4-yl)-3-phenylurea
CID 10640536
1,3-Dihydro-imidazo[4,5-b]quinolin-2-one
CID 10867033
7-Methyl-1,3-dihydro-imidazo[4,5-b]quinolin-2-one
CID 13936971
N'-(11H-indolo(3,2-c)quinolin-6-yl)-N,N-dimethylethane-1,2-diamine
CID 24204050
N-(2-quinolinyl)cyclohexanecarboxamide
CID 2812969
ST4118890
CID 657773
Indole, 3-methyl-2-(piperidinyl)-
CID 41163
5-Methyl-1,3-dihydroimidazo[4,5-b]quinolin-2-one
CID 15065143

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide?
The IUPAC name of 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide (CID 754251) is 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide?
The canonical SMILES for 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide is CC(C)C(=O)Nc1c2c(nc3ccccc13)N(C)CC2.
What is the InChIKey of 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide?
The InChIKey is KMMOBCXLHOOSGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-10(2)16(20)18-14-11-6-4-5-7-13(11)17-15-12(14)8-9-19(15)3/h4-7,10H,8-9H2,1-3H3,(H,17,18,20).
What are the key properties of 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide?
2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide has a molecular weight of 269.35 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide is sourced from PubChem (CID 754251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).