molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide

C15H23N3O4 — CID 142535899

IUPACmolecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide
SMILESNC(=O)CCC(C=O)NC(=O)Cc1ccc2c(c1)CC(=O)N2.[H][H].[H][H].[H][H]
InChIInChI=1S/C15H17N3O4.3H2/c16-13(20)4-2-11(8-19)17-14(21)6-9-1-3-12-10(5-9)7-15(22)18-12;;;/h1,3,5,8,11H,2,4,6-7H2,(H2,16,20)(H,17,21)(H,18,22);3*1H
InChIKeyRZTURGMZZZDKHX-UHFFFAOYSA-N
MW309.37 g/mol
LogP0.41
Rot. Bonds7

About molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide

molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide (PubChem CID 142535899) has the molecular formula C15H23N3O4 and a molecular weight of 309.37 g/mol. Its IUPAC name is molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide.

Molecular Properties

Compound Namemolecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide
PubChem CID142535899
Molecular FormulaC15H23N3O4
Molecular Weight309.37 g/mol
Exact Mass309.17
IUPAC Namemolecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide
SMILESNC(=O)CCC(C=O)NC(=O)Cc1ccc2c(c1)CC(=O)N2.[H][H].[H][H].[H][H]
InChIInChI=1S/C15H17N3O4.3H2/c16-13(20)4-2-11(8-19)17-14(21)6-9-1-3-12-10(5-9)7-15(22)18-12;;;/h1,3,5,8,11H,2,4,6-7H2,(H2,16,20)(H,17,21)(H,18,22);3*1H
InChIKeyRZTURGMZZZDKHX-UHFFFAOYSA-N
XLogP0.41
TPSA118.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 82490915
2-(2-oxo-1,3-dihydroindol-5-yl)-N-(1-phenylethyl)acetamide
CID 110768091
2-(2-oxo-1,3-dihydroindol-5-yl)-N-prop-2-enylacetamide
CID 110768065
N'-methyl-2-(2-oxo-1,3-dihydroindol-5-yl)acetohydrazide
CID 116846191
2-(2-oxo-1,3-dihydroindol-5-yl)acetaldehyde
CID 116927299
N-methyl-2-(2-oxo-1,3-dihydroindol-5-yl)acetohydrazide
CID 116844796
4-oxo-4-[(2-oxo-1,3-dihydroindol-5-yl)methylamino]butanoic acid
CID 82501019
3-[2-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propanoic acid
CID 112518611
N-[2-(4-fluorophenyl)ethyl]-2-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 110768108
4-[(2-oxo-1,3-dihydroindol-5-yl)methylamino]butanoic acid
CID 115218605
N-[(3R)-2,6-dioxopiperidin-3-yl]-2-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 154591725
4-[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]piperazine-1-carbaldehyde
CID 110768084

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide?
The IUPAC name of molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide (CID 142535899) is molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide.
What is the SMILES notation for molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide?
The canonical SMILES for molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide is NC(=O)CCC(C=O)NC(=O)Cc1ccc2c(c1)CC(=O)N2.[H][H].[H][H].[H][H].
What is the InChIKey of molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide?
The InChIKey is RZTURGMZZZDKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O4.3H2/c16-13(20)4-2-11(8-19)17-14(21)6-9-1-3-12-10(5-9)7-15(22)18-12;;;/h1,3,5,8,11H,2,4,6-7H2,(H2,16,20)(H,17,21)(H,18,22);3*1H.
What are the key properties of molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide?
molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide has a molecular weight of 309.37 g/mol, XLogP of 0.41, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;5-oxo-4-[[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]amino]pentanamide is sourced from PubChem (CID 142535899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).