2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide

C19H19N3O3 — CID 5003008

IUPAC2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NN3CCOCC3)c3ccccc3n2)o1
InChIInChI=1S/C19H19N3O3/c1-13-6-7-18(25-13)17-12-15(14-4-2-3-5-16(14)20-17)19(23)21-22-8-10-24-11-9-22/h2-7,12H,8-11H2,1H3,(H,21,23)
InChIKeyOIXNIZGGSIGJDC-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.78
Rot. Bonds3

About 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide

2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide (PubChem CID 5003008) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide.

Molecular Properties

Compound Name2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide
PubChem CID5003008
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NN3CCOCC3)c3ccccc3n2)o1
InChIInChI=1S/C19H19N3O3/c1-13-6-7-18(25-13)17-12-15(14-4-2-3-5-16(14)20-17)19(23)21-22-8-10-24-11-9-22/h2-7,12H,8-11H2,1H3,(H,21,23)
InChIKeyOIXNIZGGSIGJDC-UHFFFAOYSA-N
XLogP2.78
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-morpholin-4-yl-2-pyridin-4-ylquinoline-4-carboxamide
CID 2374192
2-(5-methylfuran-2-yl)-N-(2-methylpropyl)quinoline-4-carboxamide
CID 3421567
N-(3,5-dimethylphenyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 1222302
2-(5-methylfuran-2-yl)-N-[7-[[2-(5-methylfuran-2-yl)quinoline-4-carbonyl]amino]heptyl]quinoline-4-carboxamide
CID 4639931
2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 913140
2-(5-methylfuran-2-yl)-N-[(1S)-1-phenylethyl]quinoline-4-carboxamide
CID 1221741
N-ethoxy-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 18168945
N-[(1R)-1-cyclopropylethyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 9266940
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 1000925
2-(5-methylfuran-2-yl)-N-prop-2-enylquinoline-4-carboxamide
CID 3420064
N-[(3,4-dichlorophenyl)methyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 1220612
N-[2-(ethylamino)-2-oxoethyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 18145630

Frequently Asked Questions

What is the IUPAC name of 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide?
The IUPAC name of 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide (CID 5003008) is 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide.
What is the SMILES notation for 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide?
The canonical SMILES for 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide is Cc1ccc(-c2cc(C(=O)NN3CCOCC3)c3ccccc3n2)o1.
What is the InChIKey of 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide?
The InChIKey is OIXNIZGGSIGJDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-13-6-7-18(25-13)17-12-15(14-4-2-3-5-16(14)20-17)19(23)21-22-8-10-24-11-9-22/h2-7,12H,8-11H2,1H3,(H,21,23).
What are the key properties of 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide?
2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylfuran-2-yl)-N-morpholin-4-ylquinoline-4-carboxamide is sourced from PubChem (CID 5003008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).