2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide

C14H18N4O2 — CID 43577859

IUPAC2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)c1cc2c(cc1N)CC(=O)N2
InChIInChI=1S/C14H18N4O2/c1-18(7-14(20)16-9-2-3-9)12-6-11-8(4-10(12)15)5-13(19)17-11/h4,6,9H,2-3,5,7,15H2,1H3,(H,16,20)(H,17,19)
InChIKeyGRGSBEUEBRWSFB-UHFFFAOYSA-N
MW274.32 g/mol
LogP0.48
Rot. Bonds4

About 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide

2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide (PubChem CID 43577859) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide
PubChem CID43577859
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)c1cc2c(cc1N)CC(=O)N2
InChIInChI=1S/C14H18N4O2/c1-18(7-14(20)16-9-2-3-9)12-6-11-8(4-10(12)15)5-13(19)17-11/h4,6,9H,2-3,5,7,15H2,1H3,(H,16,20)(H,17,19)
InChIKeyGRGSBEUEBRWSFB-UHFFFAOYSA-N
XLogP0.48
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 50.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-amino-6-[2-(dimethylamino)ethyl-methylamino]-1,3-dihydroindol-2-one
CID 63694273
2-[(5-amino-1H-indazol-6-yl)-methylamino]-N-cyclopropylacetamide
CID 107488994
5-amino-6-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]-1,3-dihydroindol-2-one
CID 113475446
2-(2-amino-4-cyano-N-methylanilino)-N-cyclopropylacetamide
CID 43577880
3-amino-4-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-N-methylbenzamide
CID 82989263
5-amino-6-[methyl(2-propan-2-yloxyethyl)amino]-1,3-dihydroindol-2-one
CID 81059680
methyl 4-amino-3-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]benzoate
CID 82785492
2-(5-amino-N,2-dimethylanilino)-N-cyclopropylacetamide
CID 62588683
5-amino-6-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]-1,3-dihydroindol-2-one
CID 43588157
5-amino-6-[bis(2-methylpropyl)amino]-1,3-dihydroindol-2-one
CID 43587844
5-amino-6-[ethyl(propyl)amino]-1,3-dihydroindol-2-one
CID 43451835
2-[(6-amino-2-oxo-3,4-dihydro-1H-quinolin-7-yl)amino]-N-cyclopropylacetamide
CID 43568180

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide?
The IUPAC name of 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide (CID 43577859) is 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide is CN(CC(=O)NC1CC1)c1cc2c(cc1N)CC(=O)N2.
What is the InChIKey of 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide?
The InChIKey is GRGSBEUEBRWSFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-18(7-14(20)16-9-2-3-9)12-6-11-8(4-10(12)15)5-13(19)17-11/h4,6,9H,2-3,5,7,15H2,1H3,(H,16,20)(H,17,19).
What are the key properties of 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide?
2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide has a molecular weight of 274.32 g/mol, XLogP of 0.48, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)-methylamino]-N-cyclopropylacetamide is sourced from PubChem (CID 43577859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).