3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide

C24H28N2O2 — CID 56878244

IUPAC3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide
SMILESCCC1(NC(=O)CCC2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1
InChIInChI=1S/C24H28N2O2/c1-3-23(15-16-23)25-21(27)13-14-24(17-18-9-5-4-6-10-18)19-11-7-8-12-20(19)26(2)22(24)28/h4-12H,3,13-17H2,1-2H3,(H,25,27)
InChIKeyUZGNETROKLVLAJ-UHFFFAOYSA-N
MW376.50 g/mol
LogP3.98
Rot. Bonds7

About 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide

3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide (PubChem CID 56878244) has the molecular formula C24H28N2O2 and a molecular weight of 376.50 g/mol. Its IUPAC name is 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide.

Molecular Properties

Compound Name3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide
PubChem CID56878244
Molecular FormulaC24H28N2O2
Molecular Weight376.50 g/mol
Exact Mass376.22
IUPAC Name3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide
SMILESCCC1(NC(=O)CCC2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1
InChIInChI=1S/C24H28N2O2/c1-3-23(15-16-23)25-21(27)13-14-24(17-18-9-5-4-6-10-18)19-11-7-8-12-20(19)26(2)22(24)28/h4-12H,3,13-17H2,1-2H3,(H,25,27)
InChIKeyUZGNETROKLVLAJ-UHFFFAOYSA-N
XLogP3.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-[(3R)-3-benzyl-1-methyl-2-oxoindol-3-yl]propanoylamino]acetic acid
CID 95563683
3-[(3R)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-(2-hydroxyethyl)propanamide
CID 95563592
3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-butylpropanamide
CID 56862260
3-[(3S)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-(1,3-dihydroxypropan-2-yl)propanamide
CID 95558736
methyl 2-[3-(3-benzyl-1-methyl-2-oxoindol-3-yl)propanoylamino]acetate
CID 56871088
2-[3-(3-benzyl-1-methyl-2-oxoindol-3-yl)propanoylamino]-2-methylpropanamide
CID 56861665
3-[(3S)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N,N-dimethylpropanamide
CID 95554037
3-[(3S)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-(1-methoxy-2-methylpropan-2-yl)propanamide
CID 95502531
2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-phenylacetamide
CID 56873238
(3S)-3-benzyl-3-[3-(1,4-diazepan-1-yl)-3-oxopropyl]-1-methylindol-2-one
CID 95557356
(3R)-3-benzyl-1-methyl-3-[3-(1,4-oxazepan-4-yl)-3-oxopropyl]indol-2-one
CID 95528086
3-(hydroxymethyl)-1-methyl-3-(3-oxobutyl)indol-2-one
CID 132567366

Frequently Asked Questions

What is the IUPAC name of 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide?
The IUPAC name of 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide (CID 56878244) is 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide.
What is the SMILES notation for 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide?
The canonical SMILES for 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide is CCC1(NC(=O)CCC2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1.
What is the InChIKey of 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide?
The InChIKey is UZGNETROKLVLAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2/c1-3-23(15-16-23)25-21(27)13-14-24(17-18-9-5-4-6-10-18)19-11-7-8-12-20(19)26(2)22(24)28/h4-12H,3,13-17H2,1-2H3,(H,25,27).
What are the key properties of 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide?
3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide has a molecular weight of 376.50 g/mol, XLogP of 3.98, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(1-ethylcyclopropyl)propanamide is sourced from PubChem (CID 56878244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).