(3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide

C19H16N2O2 — CID 95568888

IUPAC(3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide
SMILESCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2
InChIInChI=1S/C19H16N2O2/c1-20-19(22)17-14-6-2-3-7-16(14)21-18-12(8-9-15(17)18)11-13-5-4-10-23-13/h2-7,10-11H,8-9H2,1H3,(H,20,22)/b12-11+
InChIKeyRPJFGEXWEAPVTK-VAWYXSNFSA-N
MW304.35 g/mol
LogP3.67
Rot. Bonds2

About (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide

(3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide (PubChem CID 95568888) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide.

Molecular Properties

Compound Name(3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide
PubChem CID95568888
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name(3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide
SMILESCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2
InChIInChI=1S/C19H16N2O2/c1-20-19(22)17-14-6-2-3-7-16(14)21-18-12(8-9-15(17)18)11-13-5-4-10-23-13/h2-7,10-11H,8-9H2,1H3,(H,20,22)/b12-11+
InChIKeyRPJFGEXWEAPVTK-VAWYXSNFSA-N
XLogP3.67
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(furan-2-ylmethylidene)-N-(1-methylpyrazol-3-yl)-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide
CID 126799433
(3E)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide
CID 97433279
[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate
CID 8575531
[2-(methylamino)-2-oxoethyl] (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate
CID 7959870
(2-ethoxy-2-oxoethyl) (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate
CID 27015346
[(1R)-1-cyanoethyl] (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate
CID 7240877
[2-(N-methylanilino)-2-oxoethyl] 3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate
CID 3459109
(4Z)-N-(3-aminopropyl)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxamide;dihydrochloride
CID 119405323
1-cyanoethyl 4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate
CID 4780233
[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate
CID 8575528
(4Z)-4-(furan-2-ylmethylidene)-N-methoxy-N-methyl-2,3-dihydro-1H-acridine-9-carboxamide
CID 98597111
[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate
CID 55418898

Frequently Asked Questions

What is the IUPAC name of (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide?
The IUPAC name of (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide (CID 95568888) is (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide.
What is the SMILES notation for (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide?
The canonical SMILES for (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide is CNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2.
What is the InChIKey of (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide?
The InChIKey is RPJFGEXWEAPVTK-VAWYXSNFSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-20-19(22)17-14-6-2-3-7-16(14)21-18-12(8-9-15(17)18)11-13-5-4-10-23-13/h2-7,10-11H,8-9H2,1H3,(H,20,22)/b12-11+.
What are the key properties of (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide?
(3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-3-(furan-2-ylmethylidene)-N-methyl-1,2-dihydrocyclopenta[b]quinoline-9-carboxamide is sourced from PubChem (CID 95568888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).