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

C15H17N3O — CID 4911243

IUPACN-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide
SMILESCCC(=O)NN1CCc2cc3ccc(C)cc3nc21
InChIInChI=1S/C15H17N3O/c1-3-14(19)17-18-7-6-12-9-11-5-4-10(2)8-13(11)16-15(12)18/h4-5,8-9H,3,6-7H2,1-2H3,(H,17,19)
InChIKeyWFJZMMUFBFKWOZ-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.35
Rot. Bonds2

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

N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide (PubChem CID 4911243) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide.

Molecular Properties

Compound NameN-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide
PubChem CID4911243
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide
SMILESCCC(=O)NN1CCc2cc3ccc(C)cc3nc21
InChIInChI=1S/C15H17N3O/c1-3-14(19)17-18-7-6-12-9-11-5-4-10(2)8-13(11)16-15(12)18/h4-5,8-9H,3,6-7H2,1-2H3,(H,17,19)
InChIKeyWFJZMMUFBFKWOZ-UHFFFAOYSA-N
XLogP2.35
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.35
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)propanamide?
The IUPAC name of N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide (CID 4911243) is N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide.
What is the SMILES notation for N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide?
The canonical SMILES for N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide is CCC(=O)NN1CCc2cc3ccc(C)cc3nc21.
What is the InChIKey of N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide?
The InChIKey is WFJZMMUFBFKWOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-3-14(19)17-18-7-6-12-9-11-5-4-10(2)8-13(11)16-15(12)18/h4-5,8-9H,3,6-7H2,1-2H3,(H,17,19).
What are the key properties of N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide?
N-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propanamide has a molecular weight of 255.32 g/mol, XLogP of 2.35, 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)propanamide is sourced from PubChem (CID 4911243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).