N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide

C20H19N3O2 — CID 10640396

IUPACN-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide
SMILESCN(C)CCNC(=O)c1cccc2cc3c(nc12)oc1ccccc13
InChIInChI=1S/C20H19N3O2/c1-23(2)11-10-21-19(24)15-8-5-6-13-12-16-14-7-3-4-9-17(14)25-20(16)22-18(13)15/h3-9,12H,10-11H2,1-2H3,(H,21,24)
InChIKeyLKPDQXHURZERDR-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.43
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide

N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide (PubChem CID 10640396) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide
PubChem CID10640396
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide
SMILESCN(C)CCNC(=O)c1cccc2cc3c(nc12)oc1ccccc13
InChIInChI=1S/C20H19N3O2/c1-23(2)11-10-21-19(24)15-8-5-6-13-12-16-14-7-3-4-9-17(14)25-20(16)22-18(13)15/h3-9,12H,10-11H2,1-2H3,(H,21,24)
InChIKeyLKPDQXHURZERDR-UHFFFAOYSA-N
XLogP3.43
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)ethyl]-5-phenylacridine-4-carboxamide
CID 10690459
N-[2-(dimethylamino)ethyl]-6,7-dimethylacridine-4-carboxamide
CID 54432311
N-[2-(dimethylamino)ethyl]-6,9-dimethyl-[1]benzothiolo[3,2-b]quinoline-4-carboxamide
CID 101079695
9-anilino-N-[2-(dimethylamino)ethyl]acridine-4-carboxamide
CID 59765054
N-[3-[3-[(5,8-dimethylacridine-4-carbonyl)amino]propyl-methylamino]propyl]-5,8-dimethylacridine-4-carboxamide
CID 10603794
N-[2-(dimethylamino)ethyl]-7-(trifluoromethyl)acridine-4-carboxamide
CID 11792926
9-chloro-N-[2-(dimethylamino)ethyl]-5-methylacridine-4-carboxamide
CID 10593362
N-[2-(dimethylamino)ethyl]-2-phenylbenzo[h]quinoline-4-carboxamide
CID 155517784
9-amino-N-[2-(dimethylamino)ethyl]-5-fluoroacridine-4-carboxamide
CID 1818
[5-[[4-[2-(dimethylamino)ethylcarbamoyl]acridin-9-yl]amino]-2-methylphenyl]carbamic acid
CID 91058936
N-[2-(dimethylamino)ethyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 71572132
6-(2-chlorophenyl)-N-[2-(dimethylamino)ethyl]phenanthridine-4-carboxamide;hydrochloride
CID 45262948

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide (CID 10640396) is N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide is CN(C)CCNC(=O)c1cccc2cc3c(nc12)oc1ccccc13.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide?
The InChIKey is LKPDQXHURZERDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-23(2)11-10-21-19(24)15-8-5-6-13-12-16-14-7-3-4-9-17(14)25-20(16)22-18(13)15/h3-9,12H,10-11H2,1-2H3,(H,21,24).
What are the key properties of N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide?
N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-[1]benzofuro[2,3-b]quinoline-7-carboxamide is sourced from PubChem (CID 10640396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).