N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide

C18H20N4O — CID 82252612

IUPACN-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2cccc(C3=NCCN3)c2)cc1
InChIInChI=1S/C18H20N4O/c1-22(2)16-8-6-13(7-9-16)18(23)21-15-5-3-4-14(12-15)17-19-10-11-20-17/h3-9,12H,10-11H2,1-2H3,(H,19,20)(H,21,23)
InChIKeyZBOXHTVDRXKBJU-UHFFFAOYSA-N
MW308.39 g/mol
LogP2.35
Rot. Bonds4

About N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide

N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide (PubChem CID 82252612) has the molecular formula C18H20N4O and a molecular weight of 308.39 g/mol. Its IUPAC name is N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide
PubChem CID82252612
Molecular FormulaC18H20N4O
Molecular Weight308.39 g/mol
Exact Mass308.16
IUPAC NameN-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2cccc(C3=NCCN3)c2)cc1
InChIInChI=1S/C18H20N4O/c1-22(2)16-8-6-13(7-9-16)18(23)21-15-5-3-4-14(12-15)17-19-10-11-20-17/h3-9,12H,10-11H2,1-2H3,(H,19,20)(H,21,23)
InChIKeyZBOXHTVDRXKBJU-UHFFFAOYSA-N
XLogP2.35
TPSA56.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylsulfamoyl)benzamide
CID 82253063
N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-3,4-difluorobenzamide
CID 82252406
1,3-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea
CID 20563379
1-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-3-phenylurea
CID 66919843
1-N,4-N-bis[3-(4,5-dihydro-1H-imidazol-2-yl)-5-(dimethylcarbamoyl)phenyl]benzene-1,4-dicarboxamide;hydrochloride
CID 54606215
N,N'-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]but-2-enediamide;dihydrochloride
CID 131880365
1-N,4-N-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,4-dicarboxamide;methanesulfonic acid
CID 76853603
CID 89119273
CID 89119273
4-(dimethylamino)-N-(3-hydroxyphenyl)benzamide
CID 28739881
1-N,3-N-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,3-dicarboxamide;methanesulfonic acid
CID 76853602
N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-[[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]carbamoylamino]benzamide;hydrochloride
CID 44531278
3-[(4-carbamothioylphenyl)carbamoylamino]-N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzamide
CID 21139769

Frequently Asked Questions

What is the IUPAC name of N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide?
The IUPAC name of N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide (CID 82252612) is N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide.
What is the SMILES notation for N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide?
The canonical SMILES for N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide is CN(C)c1ccc(C(=O)Nc2cccc(C3=NCCN3)c2)cc1.
What is the InChIKey of N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide?
The InChIKey is ZBOXHTVDRXKBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c1-22(2)16-8-6-13(7-9-16)18(23)21-15-5-3-4-14(12-15)17-19-10-11-20-17/h3-9,12H,10-11H2,1-2H3,(H,19,20)(H,21,23).
What are the key properties of N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide?
N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide has a molecular weight of 308.39 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4-(dimethylamino)benzamide is sourced from PubChem (CID 82252612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).