N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide

C18H19N3O4 — CID 47048455

IUPACN-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide
SMILESCC(NC(=O)CCNC(=O)c1ccco1)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C18H19N3O4/c1-11(12-4-5-14-13(9-12)10-17(23)21-14)20-16(22)6-7-19-18(24)15-3-2-8-25-15/h2-5,8-9,11H,6-7,10H2,1H3,(H,19,24)(H,20,22)(H,21,23)
InChIKeyMOYWMWDIICPIAI-UHFFFAOYSA-N
MW341.37 g/mol
LogP1.77
Rot. Bonds6

About N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide

N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide (PubChem CID 47048455) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide
PubChem CID47048455
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC NameN-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide
SMILESCC(NC(=O)CCNC(=O)c1ccco1)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C18H19N3O4/c1-11(12-4-5-14-13(9-12)10-17(23)21-14)20-16(22)6-7-19-18(24)15-3-2-8-25-15/h2-5,8-9,11H,6-7,10H2,1H3,(H,19,24)(H,20,22)(H,21,23)
InChIKeyMOYWMWDIICPIAI-UHFFFAOYSA-N
XLogP1.77
TPSA100.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[[(1S)-1-(3,4-difluorophenyl)ethyl]amino]-3-oxopropyl]furan-2-carboxamide
CID 25479336
7-amino-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]heptanamide
CID 119736199
N-[4-[1-(1,3-benzodioxol-5-yl)ethylamino]-4-oxobutyl]furan-2-carboxamide
CID 42934368
N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-3-phenylfuran-2-carboxamide
CID 154774789
1-[2-(1-methylpyrazol-4-yl)ethyl]-3-[(1S)-1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]urea
CID 97088663
N-[2-oxo-2-[[2-oxo-2-[[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]amino]ethyl]amino]ethyl]furan-2-carboxamide
CID 9396624
N-[2-oxo-2-[[2-oxo-2-[[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]amino]ethyl]amino]ethyl]furan-2-carboxamide
CID 9396618
2-(2-oxo-1,3-dihydroindol-5-yl)-N-(1-phenylethyl)acetamide
CID 110768091
N-[3-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-3-oxopropyl]furan-2-carboxamide
CID 43031477
3-[3-(furan-2-carbonylamino)propanoylamino]butanoic acid
CID 43172663
2-[3-(furan-2-carbonylamino)propanoylamino]-4-methylpentanoic acid
CID 43092601
2-methyl-3-(methylamino)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propanamide
CID 119736221

Frequently Asked Questions

What is the IUPAC name of N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide?
The IUPAC name of N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide (CID 47048455) is N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide?
The canonical SMILES for N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide is CC(NC(=O)CCNC(=O)c1ccco1)c1ccc2c(c1)CC(=O)N2.
What is the InChIKey of N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide?
The InChIKey is MOYWMWDIICPIAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-11(12-4-5-14-13(9-12)10-17(23)21-14)20-16(22)6-7-19-18(24)15-3-2-8-25-15/h2-5,8-9,11H,6-7,10H2,1H3,(H,19,24)(H,20,22)(H,21,23).
What are the key properties of N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide?
N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide has a molecular weight of 341.37 g/mol, XLogP of 1.77, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-oxo-3-[1-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propyl]furan-2-carboxamide is sourced from PubChem (CID 47048455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).