N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide

C20H16N2O3 — CID 3237608

IUPACN-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NCc3ccco3)c3ccccc3n2)o1
InChIInChI=1S/C20H16N2O3/c1-13-8-9-19(25-13)18-11-16(15-6-2-3-7-17(15)22-18)20(23)21-12-14-5-4-10-24-14/h2-11H,12H2,1H3,(H,21,23)
InChIKeyXDJGRFVVVPCXCN-UHFFFAOYSA-N
MW332.36 g/mol
LogP4.33
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide

N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide (PubChem CID 3237608) has the molecular formula C20H16N2O3 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
PubChem CID3237608
Molecular FormulaC20H16N2O3
Molecular Weight332.36 g/mol
Exact Mass332.12
IUPAC NameN-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NCc3ccco3)c3ccccc3n2)o1
InChIInChI=1S/C20H16N2O3/c1-13-8-9-19(25-13)18-11-16(15-6-2-3-7-17(15)22-18)20(23)21-12-14-5-4-10-24-14/h2-11H,12H2,1H3,(H,21,23)
InChIKeyXDJGRFVVVPCXCN-UHFFFAOYSA-N
XLogP4.33
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(Furan-2-yl)quinoline-4-carboxylic acid
CID 697640
2-(5-methylfuran-2-yl)-N-(4-methylphenyl)quinoline-4-carboxamide
CID 868700
1,2-Ethanediamine, N'-(2-(2-furanyl)-4-quinolinyl)-N,N-dimethyl-
CID 453072
2-(furan-2-yl)-N-(4-methoxyphenyl)quinoline-4-carboxamide
CID 903397
Ethyl 4-(furan-2-ylmethylamino)quinoline-3-carboxylate
CID 709114
Methyl 1-(2-(furan-2-yl)quinoline-4-carbonyl)piperidine-4-carboxylate
CID 2420130
1-(4-(2-(5-Methylfuran-2-yl)quinoline-4-carbonyl)piperazin-1-yl)ethan-1-one
CID 24980435
2-(5-Methylfuran-2-yl)quinoline-4-carboxylic acid
CID 693021
6-Methoxy-2-(piperidin-1-ylcarbonyl)furo[2,3-b]quinoline
CID 3237525
N,N-dimethylformamide; 2-(2-furyl)-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-4-carboxamide
CID 16241726
N-[2-(5-methoxy-2-phenylfuro[3,2-b]pyridin-3-yl)ethyl]acetamide
CID 127042142
6-fluoro-N-(2-furylmethyl)-2-methyl-4-quinolinecarboxamide
CID 826914

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide (CID 3237608) is N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide is Cc1ccc(-c2cc(C(=O)NCc3ccco3)c3ccccc3n2)o1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide?
The InChIKey is XDJGRFVVVPCXCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O3/c1-13-8-9-19(25-13)18-11-16(15-6-2-3-7-17(15)22-18)20(23)21-12-14-5-4-10-24-14/h2-11H,12H2,1H3,(H,21,23).
What are the key properties of N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide?
N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide has a molecular weight of 332.36 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide is sourced from PubChem (CID 3237608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).