4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide

C24H20N4O — CID 18859131

IUPAC4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide
SMILESCc1ccc2cc3c(nc2c1)N(c1ccc(C(=O)Nc2ccccn2)cc1)CC3
InChIInChI=1S/C24H20N4O/c1-16-5-6-18-15-19-11-13-28(23(19)26-21(18)14-16)20-9-7-17(8-10-20)24(29)27-22-4-2-3-12-25-22/h2-10,12,14-15H,11,13H2,1H3,(H,25,27,29)
InChIKeyGKRMIUJYOPTIBQ-UHFFFAOYSA-N
MW380.45 g/mol
LogP4.88
Rot. Bonds3

About 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide

4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide (PubChem CID 18859131) has the molecular formula C24H20N4O and a molecular weight of 380.45 g/mol. Its IUPAC name is 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide
PubChem CID18859131
Molecular FormulaC24H20N4O
Molecular Weight380.45 g/mol
Exact Mass380.16
IUPAC Name4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide
SMILESCc1ccc2cc3c(nc2c1)N(c1ccc(C(=O)Nc2ccccn2)cc1)CC3
InChIInChI=1S/C24H20N4O/c1-16-5-6-18-15-19-11-13-28(23(19)26-21(18)14-16)20-9-7-17(8-10-20)24(29)27-22-4-2-3-12-25-22/h2-10,12,14-15H,11,13H2,1H3,(H,25,27,29)
InChIKeyGKRMIUJYOPTIBQ-UHFFFAOYSA-N
XLogP4.88
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-(3-methyl-2-pyridinyl)benzamide
CID 18858987
4-methyl-N'-[4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzoyl]benzohydrazide
CID 18859092
4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-(2-nitrophenyl)benzamide
CID 18859076
4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 18859133
N-(2,5-dimethylphenyl)-4-(7-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide
CID 18859194
N-(5-chloro-2-pyridinyl)-4-(7-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide
CID 18859231
4-(7-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 18859300
N-(3-imidazol-1-ylpropyl)-4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide
CID 18858986
methyl 4-[[4-(7-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzoyl]amino]benzoate
CID 18859254
N-(4-iodophenyl)-4-(7-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide
CID 18859249
N-(4-chloro-2-methylphenyl)-4-(7-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)benzamide
CID 18859191
1-(2,4-dimethylphenyl)-7-methyl-2,3-dihydropyrrolo[2,3-b]quinoline
CID 18846763

Frequently Asked Questions

What is the IUPAC name of 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide?
The IUPAC name of 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide (CID 18859131) is 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide.
What is the SMILES notation for 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide?
The canonical SMILES for 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide is Cc1ccc2cc3c(nc2c1)N(c1ccc(C(=O)Nc2ccccn2)cc1)CC3.
What is the InChIKey of 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide?
The InChIKey is GKRMIUJYOPTIBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O/c1-16-5-6-18-15-19-11-13-28(23(19)26-21(18)14-16)20-9-7-17(8-10-20)24(29)27-22-4-2-3-12-25-22/h2-10,12,14-15H,11,13H2,1H3,(H,25,27,29).
What are the key properties of 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide?
4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide has a molecular weight of 380.45 g/mol, XLogP of 4.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-N-pyridin-2-ylbenzamide is sourced from PubChem (CID 18859131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).