N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide

C17H18N2O3 — CID 110788700

IUPACN-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide
SMILESCN1C(=O)CCc2cc(CCNC(=O)c3ccco3)ccc21
InChIInChI=1S/C17H18N2O3/c1-19-14-6-4-12(11-13(14)5-7-16(19)20)8-9-18-17(21)15-3-2-10-22-15/h2-4,6,10-11H,5,7-9H2,1H3,(H,18,21)
InChIKeyXKVZRJAKXLYOBV-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.16
Rot. Bonds4

About N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide

N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide (PubChem CID 110788700) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide
PubChem CID110788700
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide
SMILESCN1C(=O)CCc2cc(CCNC(=O)c3ccco3)ccc21
InChIInChI=1S/C17H18N2O3/c1-19-14-6-4-12(11-13(14)5-7-16(19)20)8-9-18-17(21)15-3-2-10-22-15/h2-4,6,10-11H,5,7-9H2,1H3,(H,18,21)
InChIKeyXKVZRJAKXLYOBV-UHFFFAOYSA-N
XLogP2.16
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-methyl-2-oxo-3H-indol-5-yl)ethyl]furan-2-carboxamide
CID 110788529
4-chloro-N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]benzamide
CID 110788721
N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)furan-2-carboxamide
CID 18571249
N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]-2-oxoacetamide
CID 115166541
3-methoxy-N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]benzamide
CID 110788711
N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]-2-(2-methylphenyl)acetamide
CID 110788734
6-[2-(hydroxymethylamino)ethyl]-1-methyl-3,4-dihydroquinolin-2-one
CID 115229304
1-methyl-6-[2-(propan-2-ylamino)ethyl]-3,4-dihydroquinolin-2-one
CID 82479603
1-cyclopentyl-3-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]urea
CID 110775819
N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]furan-2-carboxamide
CID 110481071
3-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)propanoic acid
CID 82116153
1-methyl-2-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-3,4-dihydroquinoline-6-carboxamide
CID 110383928

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide (CID 110788700) is N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide is CN1C(=O)CCc2cc(CCNC(=O)c3ccco3)ccc21.
What is the InChIKey of N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide?
The InChIKey is XKVZRJAKXLYOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-19-14-6-4-12(11-13(14)5-7-16(19)20)8-9-18-17(21)15-3-2-10-22-15/h2-4,6,10-11H,5,7-9H2,1H3,(H,18,21).
What are the key properties of N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide?
N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide has a molecular weight of 298.34 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 110788700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).