N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide

C20H23N3O2 — CID 136529868

IUPACN-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide
SMILESCN(C)CCc1ccc(NC(=O)Cc2ccc3c(c2)NC(=O)C3)cc1
InChIInChI=1S/C20H23N3O2/c1-23(2)10-9-14-4-7-17(8-5-14)21-19(24)12-15-3-6-16-13-20(25)22-18(16)11-15/h3-8,11H,9-10,12-13H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyBCDHLYQNCGPQPC-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.47
Rot. Bonds6

About N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide

N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide (PubChem CID 136529868) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide.

Molecular Properties

Compound NameN-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide
PubChem CID136529868
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide
SMILESCN(C)CCc1ccc(NC(=O)Cc2ccc3c(c2)NC(=O)C3)cc1
InChIInChI=1S/C20H23N3O2/c1-23(2)10-9-14-4-7-17(8-5-14)21-19(24)12-15-3-6-16-13-20(25)22-18(16)11-15/h3-8,11H,9-10,12-13H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyBCDHLYQNCGPQPC-UHFFFAOYSA-N
XLogP2.47
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(diethylamino)-3-pyridinyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide
CID 75476917
N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide
CID 122140644
N-[4-[2-oxo-2-[(2-oxo-1,3-dihydroindol-6-yl)amino]ethyl]phenyl]cyclopropanecarboxamide
CID 166252588
2-(2-oxo-1,3-dihydroindol-6-yl)acetic acid
CID 2750259
2-(2-oxo-1,3-dihydroindol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 110768191
N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide
CID 154795458
N-[4-(dimethylamino)phenyl]-2-(3-oxo-4H-1,4-benzothiazin-6-yl)acetamide
CID 110771553
1-(4-methylphenyl)-3-(2-oxo-1,3-dihydroindol-6-yl)urea
CID 165032229
N-(4-tert-butylphenyl)-2-(3-oxo-4H-1,4-benzoxazin-6-yl)acetamide
CID 110770318
[4-[2-(dimethylamino)ethyl]phenyl]urea
CID 150231962
2-(2-oxo-1,3-dihydroindol-6-yl)-N-[(2R)-4-oxo-4-phenylbutan-2-yl]acetamide
CID 124616807
N-[4-[2-(dimethylamino)ethylamino]phenyl]-2-(4-fluorophenyl)acetamide
CID 112981313

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide?
The IUPAC name of N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide (CID 136529868) is N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide.
What is the SMILES notation for N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide?
The canonical SMILES for N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide is CN(C)CCc1ccc(NC(=O)Cc2ccc3c(c2)NC(=O)C3)cc1.
What is the InChIKey of N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide?
The InChIKey is BCDHLYQNCGPQPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-23(2)10-9-14-4-7-17(8-5-14)21-19(24)12-15-3-6-16-13-20(25)22-18(16)11-15/h3-8,11H,9-10,12-13H2,1-2H3,(H,21,24)(H,22,25).
What are the key properties of N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide?
N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide has a molecular weight of 337.42 g/mol, XLogP of 2.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(dimethylamino)ethyl]phenyl]-2-(2-oxo-1,3-dihydroindol-6-yl)acetamide is sourced from PubChem (CID 136529868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).