N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide

C26H26N2O4 — CID 33259015

IUPACN-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide
SMILESCc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc1C
InChIInChI=1S/C26H26N2O4/c1-17-9-10-19(15-18(17)2)25(30)22-7-5-6-8-23(22)26(31)27-20-11-13-21(14-12-20)32-16-24(29)28(3)4/h5-15H,16H2,1-4H3,(H,27,31)
InChIKeyDWGHZHGIBVNCRL-UHFFFAOYSA-N
MW430.50 g/mol
LogP4.25
Rot. Bonds7

About N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide

N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide (PubChem CID 33259015) has the molecular formula C26H26N2O4 and a molecular weight of 430.50 g/mol. Its IUPAC name is N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide.

Molecular Properties

Compound NameN-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide
PubChem CID33259015
Molecular FormulaC26H26N2O4
Molecular Weight430.50 g/mol
Exact Mass430.19
IUPAC NameN-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide
SMILESCc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc1C
InChIInChI=1S/C26H26N2O4/c1-17-9-10-19(15-18(17)2)25(30)22-7-5-6-8-23(22)26(31)27-20-11-13-21(14-12-20)32-16-24(29)28(3)4/h5-15H,16H2,1-4H3,(H,27,31)
InChIKeyDWGHZHGIBVNCRL-UHFFFAOYSA-N
XLogP4.25
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.50
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-tert-butyl-N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]benzamide
CID 75385769
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-4-methoxybenzamide
CID 32943268
2-[2-(dimethylamino)-2-oxoethoxy]-N-(4-methoxyphenyl)benzamide
CID 34815754
3-(benzylsulfamoyl)-N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-4-methylbenzamide
CID 30860385
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]quinoline-8-carboxamide
CID 32944118
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-oxo-1H-quinoline-4-carboxamide
CID 32943769
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-4-propan-2-ylbenzamide
CID 32943301
N-[3-(diethylcarbamoyl)phenyl]-2-(3,4-dimethylbenzoyl)benzamide
CID 36835148
4-[[2-(3,4-dimethylphenoxy)acetyl]amino]-N-phenylbenzamide
CID 17359274
N-(4-ethoxyphenyl)-2-methylbenzamide
CID 710558
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-4-nitrobenzamide
CID 32943243
2-chloro-N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-5-(dimethylsulfamoyl)benzamide
CID 30860063

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide?
The IUPAC name of N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide (CID 33259015) is N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide.
What is the SMILES notation for N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide?
The canonical SMILES for N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide is Cc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc1C.
What is the InChIKey of N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide?
The InChIKey is DWGHZHGIBVNCRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O4/c1-17-9-10-19(15-18(17)2)25(30)22-7-5-6-8-23(22)26(31)27-20-11-13-21(14-12-20)32-16-24(29)28(3)4/h5-15H,16H2,1-4H3,(H,27,31).
What are the key properties of N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide?
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide has a molecular weight of 430.50 g/mol, XLogP of 4.25, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-(3,4-dimethylbenzoyl)benzamide is sourced from PubChem (CID 33259015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).