4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide

C18H18N2O2 — CID 110781426

IUPAC4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide
SMILESCc1ccc(C(=O)NCc2ccc3c(c2)CC(=O)N3C)cc1
InChIInChI=1S/C18H18N2O2/c1-12-3-6-14(7-4-12)18(22)19-11-13-5-8-16-15(9-13)10-17(21)20(16)2/h3-9H,10-11H2,1-2H3,(H,19,22)
InChIKeyGOBVNMUQHJZMBJ-UHFFFAOYSA-N
MW294.35 g/mol
LogP2.44
Rot. Bonds3

About 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide

4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide (PubChem CID 110781426) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide
PubChem CID110781426
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide
SMILESCc1ccc(C(=O)NCc2ccc3c(c2)CC(=O)N3C)cc1
InChIInChI=1S/C18H18N2O2/c1-12-3-6-14(7-4-12)18(22)19-11-13-5-8-16-15(9-13)10-17(21)20(16)2/h3-9H,10-11H2,1-2H3,(H,19,22)
InChIKeyGOBVNMUQHJZMBJ-UHFFFAOYSA-N
XLogP2.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-N-[(4-methylphenyl)methyl]-2-oxo-3H-indole-5-carboxamide
CID 52986160
N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]carbamoyl bromide
CID 115193579
N-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)methyl]-2-(4-methylphenyl)acetamide
CID 110781697
2-ethyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]butanamide
CID 110781420
1-amino-3-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]urea
CID 115192631
N-benzyl-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
CID 110768263
N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]azetidine-1-carboxamide
CID 146105714
N-[2-(1-methyl-2-oxo-3H-indol-5-yl)ethyl]-3-(4-methylphenyl)propanamide
CID 110788570
N-(cyanomethyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
CID 82477992
N-(2-aminoethyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
CID 82295802
N-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)methyl]butanamide
CID 110781637
N-(2,4-dimethylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
CID 110768321

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide?
The IUPAC name of 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide (CID 110781426) is 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide.
What is the SMILES notation for 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide?
The canonical SMILES for 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide is Cc1ccc(C(=O)NCc2ccc3c(c2)CC(=O)N3C)cc1.
What is the InChIKey of 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide?
The InChIKey is GOBVNMUQHJZMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-12-3-6-14(7-4-12)18(22)19-11-13-5-8-16-15(9-13)10-17(21)20(16)2/h3-9H,10-11H2,1-2H3,(H,19,22).
What are the key properties of 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide?
4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide has a molecular weight of 294.35 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]benzamide is sourced from PubChem (CID 110781426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).