4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide

C13H17N3O2 — CID 115156546

IUPAC4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide
SMILESCC(N)CCC(=O)Nc1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C13H17N3O2/c1-8(14)2-5-12(17)15-10-3-4-11-9(6-10)7-13(18)16-11/h3-4,6,8H,2,5,7,14H2,1H3,(H,15,17)(H,16,18)
InChIKeyIPIDVQZVFFQRFX-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.25
Rot. Bonds4

About 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide

4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide (PubChem CID 115156546) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide.

Molecular Properties

Compound Name4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide
PubChem CID115156546
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide
SMILESCC(N)CCC(=O)Nc1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C13H17N3O2/c1-8(14)2-5-12(17)15-10-3-4-11-9(6-10)7-13(18)16-11/h3-4,6,8H,2,5,7,14H2,1H3,(H,15,17)(H,16,18)
InChIKeyIPIDVQZVFFQRFX-UHFFFAOYSA-N
XLogP1.25
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(2-oxo-1,3-dihydroindol-5-yl)propanamide
CID 119281522
(2R)-2-amino-N-(2-oxo-1,3-dihydroindol-5-yl)propanamide;hydrochloride
CID 119281521
4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)butanamide
CID 22690108
7-amino-N-(2-oxo-1,3-dihydroindol-5-yl)heptanamide
CID 119709201
3-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)butanamide
CID 60837196
3-cyclopentyl-N-(2-oxo-1,3-dihydroindol-5-yl)propanamide
CID 18570800
3-amino-2-hydroxy-N-(2-oxo-1,3-dihydroindol-5-yl)propanamide
CID 115180257
N-(3-aminobutyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 102711492
2-(2-fluorophenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 110777106
3-hydroxy-N-(2-oxo-1,3-dihydroindol-5-yl)-3-phenylbutanamide
CID 110025383
3-(3-fluorophenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)propanamide
CID 110777102
5-(2,3-diaminopropylamino)-1,3-dihydroindol-2-one
CID 115119380

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide?
The IUPAC name of 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide (CID 115156546) is 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide.
What is the SMILES notation for 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide?
The canonical SMILES for 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide is CC(N)CCC(=O)Nc1ccc2c(c1)CC(=O)N2.
What is the InChIKey of 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide?
The InChIKey is IPIDVQZVFFQRFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-8(14)2-5-12(17)15-10-3-4-11-9(6-10)7-13(18)16-11/h3-4,6,8H,2,5,7,14H2,1H3,(H,15,17)(H,16,18).
What are the key properties of 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide?
4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide has a molecular weight of 247.30 g/mol, XLogP of 1.25, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)pentanamide is sourced from PubChem (CID 115156546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).