N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide

C24H25N3O2 — CID 70144629

IUPACN-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide
SMILESCN(C)CCNC(=O)c1cccc(NC(=O)c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C24H25N3O2/c1-27(2)16-15-25-23(28)19-11-8-12-20(17-19)26-24(29)22-14-7-6-13-21(22)18-9-4-3-5-10-18/h3-14,17H,15-16H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyKPCJGWFJBQHDDK-UHFFFAOYSA-N
MW387.48 g/mol
LogP3.90
Rot. Bonds7

About N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide

N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide (PubChem CID 70144629) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide.

Molecular Properties

Compound NameN-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide
PubChem CID70144629
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC NameN-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide
SMILESCN(C)CCNC(=O)c1cccc(NC(=O)c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C24H25N3O2/c1-27(2)16-15-25-23(28)19-11-8-12-20(17-19)26-24(29)22-14-7-6-13-21(22)18-9-4-3-5-10-18/h3-14,17H,15-16H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyKPCJGWFJBQHDDK-UHFFFAOYSA-N
XLogP3.90
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(3-acetylphenyl)-1-N-[2-(dimethylamino)ethyl]benzene-1,3-dicarboxamide
CID 109053236
methyl 3-[[3-[2-(dimethylamino)ethylcarbamoyl]benzoyl]amino]benzoate
CID 109053241
2-[2-(dimethylamino)ethylcarbamoyl]-6-phenylbenzoic acid
CID 123504584
N-[3-[ethyl(methyl)amino]phenyl]-2-phenylbenzamide
CID 47089077
methyl 3-[[4-[2-(dimethylamino)ethylcarbamoyl]benzoyl]amino]benzoate
CID 109045824
3-[[2-(4-methylphenyl)benzoyl]amino]benzoic acid;hydrochloride
CID 70145450
N-[2-(dimethylamino)ethyl]-5-phenylacridine-4-carboxamide
CID 10690459
1-N-[2-(dimethylamino)ethyl]-3-N-[3-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide
CID 109053234
2-phenyl-N-[3-(phenylcarbamoylamino)phenyl]benzamide
CID 31812149
3-[[4-[bis(2-chloroethyl)amino]phenyl]carbamoylamino]-N-[2-(dimethylamino)ethyl]benzamide
CID 25018558
N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide
CID 91804668
N-[3-(diethylaminomethyl)phenyl]-2-phenylbenzamide
CID 38755706

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide?
The IUPAC name of N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide (CID 70144629) is N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide.
What is the SMILES notation for N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide?
The canonical SMILES for N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide is CN(C)CCNC(=O)c1cccc(NC(=O)c2ccccc2-c2ccccc2)c1.
What is the InChIKey of N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide?
The InChIKey is KPCJGWFJBQHDDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-27(2)16-15-25-23(28)19-11-8-12-20(17-19)26-24(29)22-14-7-6-13-21(22)18-9-4-3-5-10-18/h3-14,17H,15-16H2,1-2H3,(H,25,28)(H,26,29).
What are the key properties of N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide?
N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide has a molecular weight of 387.48 g/mol, XLogP of 3.90, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(dimethylamino)ethylcarbamoyl]phenyl]-2-phenylbenzamide is sourced from PubChem (CID 70144629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).