N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide

C20H20N2O4 — CID 110344820

IUPACN-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide
SMILESCOc1ccccc1CNC(=O)CCC(=O)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C20H20N2O4/c1-26-18-5-3-2-4-14(18)12-21-19(24)9-8-17(23)13-6-7-16-15(10-13)11-20(25)22-16/h2-7,10H,8-9,11-12H2,1H3,(H,21,24)(H,22,25)
InChIKeyLNDVMMYUCBESSD-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.47
Rot. Bonds7

About N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide

N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide (PubChem CID 110344820) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide
PubChem CID110344820
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC NameN-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide
SMILESCOc1ccccc1CNC(=O)CCC(=O)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C20H20N2O4/c1-26-18-5-3-2-4-14(18)12-21-19(24)9-8-17(23)13-6-7-16-15(10-13)11-20(25)22-16/h2-7,10H,8-9,11-12H2,1H3,(H,21,24)(H,22,25)
InChIKeyLNDVMMYUCBESSD-UHFFFAOYSA-N
XLogP2.47
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methoxyphenyl)methyl]-2-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 110768097
N-[(2-methoxyphenyl)methyl]-2-[(2-oxo-1,3-dihydroindol-5-yl)sulfonylamino]acetamide
CID 112992769
N-[(2-methoxyphenyl)methyl]-4-oxo-4-phenylbutanamide
CID 9246368
4-(3-chlorophenyl)-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide
CID 110410161
N-(2-methylphenyl)-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide
CID 110344864
5-[2-(4-methoxyphenyl)acetyl]-1,3-dihydroindol-2-one
CID 43338604
4-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-methoxyphenyl)ethyl]-4-oxobutanamide
CID 31115610
[2-oxo-2-(2-oxo-1,3-dihydroindol-5-yl)ethyl] 4-methoxynaphthalene-1-carboxylate
CID 8597204
[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl] 3-oxo-4H-1,4-benzoxazine-7-carboxylate
CID 30154625
N-cyclopentyl-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide
CID 110344793
N-(4-ethoxyphenyl)-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide
CID 110344890
5-[2-(methylamino)acetyl]-1,3-dihydroindol-2-one
CID 82112676

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide (CID 110344820) is N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide is COc1ccccc1CNC(=O)CCC(=O)c1ccc2c(c1)CC(=O)N2.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide?
The InChIKey is LNDVMMYUCBESSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-26-18-5-3-2-4-14(18)12-21-19(24)9-8-17(23)13-6-7-16-15(10-13)11-20(25)22-16/h2-7,10H,8-9,11-12H2,1H3,(H,21,24)(H,22,25).
What are the key properties of N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide?
N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide has a molecular weight of 352.39 g/mol, XLogP of 2.47, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-4-oxo-4-(2-oxo-1,3-dihydroindol-5-yl)butanamide is sourced from PubChem (CID 110344820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).