N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide

C19H17N3O — CID 4909849

IUPACN-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide
SMILESCc1ccc2cc3c(nc2c1)N(NC(=O)c1ccccc1)CC3
InChIInChI=1S/C19H17N3O/c1-13-7-8-15-12-16-9-10-22(18(16)20-17(15)11-13)21-19(23)14-5-3-2-4-6-14/h2-8,11-12H,9-10H2,1H3,(H,21,23)
InChIKeyCXKLQORQIFYJRG-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.25
Rot. Bonds2

About N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide

N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide (PubChem CID 4909849) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide.

Molecular Properties

Compound NameN-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide
PubChem CID4909849
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC NameN-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide
SMILESCc1ccc2cc3c(nc2c1)N(NC(=O)c1ccccc1)CC3
InChIInChI=1S/C19H17N3O/c1-13-7-8-15-12-16-9-10-22(18(16)20-17(15)11-13)21-19(23)14-5-3-2-4-6-14/h2-8,11-12H,9-10H2,1H3,(H,21,23)
InChIKeyCXKLQORQIFYJRG-UHFFFAOYSA-N
XLogP3.25
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide?
The IUPAC name of N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide (CID 4909849) is N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide.
What is the SMILES notation for N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide?
The canonical SMILES for N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide is Cc1ccc2cc3c(nc2c1)N(NC(=O)c1ccccc1)CC3.
What is the InChIKey of N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide?
The InChIKey is CXKLQORQIFYJRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c1-13-7-8-15-12-16-9-10-22(18(16)20-17(15)11-13)21-19(23)14-5-3-2-4-6-14/h2-8,11-12H,9-10H2,1H3,(H,21,23).
What are the key properties of N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide?
N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide has a molecular weight of 303.37 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide is sourced from PubChem (CID 4909849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).