3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide

C19H20N2O2 — CID 110730027

IUPAC3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide
SMILESCc1ccc(C(=O)NCCN2C(=O)Cc3ccccc32)cc1C
InChIInChI=1S/C19H20N2O2/c1-13-7-8-16(11-14(13)2)19(23)20-9-10-21-17-6-4-3-5-15(17)12-18(21)22/h3-8,11H,9-10,12H2,1-2H3,(H,20,23)
InChIKeyAIWPIDUGWMVXCG-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.62
Rot. Bonds4

About 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide

3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide (PubChem CID 110730027) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide.

Molecular Properties

Compound Name3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide
PubChem CID110730027
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide
SMILESCc1ccc(C(=O)NCCN2C(=O)Cc3ccccc32)cc1C
InChIInChI=1S/C19H20N2O2/c1-13-7-8-16(11-14(13)2)19(23)20-9-10-21-17-6-4-3-5-15(17)12-18(21)22/h3-8,11H,9-10,12H2,1-2H3,(H,20,23)
InChIKeyAIWPIDUGWMVXCG-UHFFFAOYSA-N
XLogP2.62
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-difluoro-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide
CID 110730047
4-chloro-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide
CID 110730041
2-(3-methylphenyl)-N-[2-(2-oxo-3H-indol-1-yl)ethyl]acetamide
CID 110730070
3,3-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]butanamide
CID 110730062
2,3,4-trifluoro-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide
CID 110730048
1-amino-N-[2-(2-oxo-3H-indol-1-yl)ethyl]cyclopropane-1-carboxamide
CID 119745257
2-methyl-3-(methylamino)-N-[2-(2-oxo-3H-indol-1-yl)ethyl]propanamide;hydrochloride
CID 119745286
2-(4-methoxyphenyl)-N-[2-(2-oxo-3H-indol-1-yl)ethyl]acetamide
CID 110730034
1-(3,4-dimethylphenyl)-2-[2-(2-oxo-3H-indol-1-yl)ethyl]guanidine
CID 119120151
1-(4-oxopentyl)-3H-indol-2-one
CID 114999184
3-(2-fluorophenyl)-N-[2-(2-oxo-3H-indol-1-yl)ethyl]propanamide
CID 110730068
1-ethyl-2-oxo-N-propyl-3H-indole-5-carboxamide
CID 71840741

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide?
The IUPAC name of 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide (CID 110730027) is 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide.
What is the SMILES notation for 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide?
The canonical SMILES for 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide is Cc1ccc(C(=O)NCCN2C(=O)Cc3ccccc32)cc1C.
What is the InChIKey of 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide?
The InChIKey is AIWPIDUGWMVXCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-13-7-8-16(11-14(13)2)19(23)20-9-10-21-17-6-4-3-5-15(17)12-18(21)22/h3-8,11H,9-10,12H2,1-2H3,(H,20,23).
What are the key properties of 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide?
3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide has a molecular weight of 308.38 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide is sourced from PubChem (CID 110730027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).