N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide

C19H21ClN4O — CID 70670824

IUPACN-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide
SMILESCN1CCN=C1c1ccc(C(=O)Nc2ccc(Cl)cc2N(C)C)cc1
InChIInChI=1S/C19H21ClN4O/c1-23(2)17-12-15(20)8-9-16(17)22-19(25)14-6-4-13(5-7-14)18-21-10-11-24(18)3/h4-9,12H,10-11H2,1-3H3,(H,22,25)
InChIKeyNZTXEGDNIJSUNE-UHFFFAOYSA-N
MW356.86 g/mol
LogP3.35
Rot. Bonds4

About N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide

N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide (PubChem CID 70670824) has the molecular formula C19H21ClN4O and a molecular weight of 356.86 g/mol. Its IUPAC name is N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide.

Molecular Properties

Compound NameN-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide
PubChem CID70670824
Molecular FormulaC19H21ClN4O
Molecular Weight356.86 g/mol
Exact Mass356.14
IUPAC NameN-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide
SMILESCN1CCN=C1c1ccc(C(=O)Nc2ccc(Cl)cc2N(C)C)cc1
InChIInChI=1S/C19H21ClN4O/c1-23(2)17-12-15(20)8-9-16(17)22-19(25)14-6-4-13(5-7-14)18-21-10-11-24(18)3/h4-9,12H,10-11H2,1-3H3,(H,22,25)
InChIKeyNZTXEGDNIJSUNE-UHFFFAOYSA-N
XLogP3.35
TPSA47.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.86
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(5-chloro-2-pyridinyl)-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
CID 10162145
N-(4-chloro-2-fluorophenyl)-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
CID 18727930
N-(4-chlorophenyl)-5-methoxy-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
CID 18728030
N-(5-chloro-2-pyridinyl)-5-[2-(dimethylamino)ethylsulfanyl]-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
CID 11376092
3,5-dichloro-N-(5-chloro-2-pyridinyl)-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
CID 10207342
N-(5-bromo-2-pyridinyl)-5-chloro-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide;N-(5-bromo-2-pyridinyl)-5-chloro-2-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]benzamide
CID 162069511
5-chloro-N-(5-chloro-2-pyridinyl)-2-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]benzamide
CID 148805295
5-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-N-(5-chloro-2-pyridinyl)-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]benzamide
CID 11192742
1-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]ethanone
CID 84670715
5-fluoro-2-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]-N-(5-methyl-2-pyridinyl)benzamide
CID 70670957
4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide
CID 55336483
N-[5-chloro-2-(dimethylamino)phenyl]-4-pyrazol-1-ylbenzamide
CID 55369232

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide?
The IUPAC name of N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide (CID 70670824) is N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide.
What is the SMILES notation for N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide?
The canonical SMILES for N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide is CN1CCN=C1c1ccc(C(=O)Nc2ccc(Cl)cc2N(C)C)cc1.
What is the InChIKey of N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide?
The InChIKey is NZTXEGDNIJSUNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN4O/c1-23(2)17-12-15(20)8-9-16(17)22-19(25)14-6-4-13(5-7-14)18-21-10-11-24(18)3/h4-9,12H,10-11H2,1-3H3,(H,22,25).
What are the key properties of N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide?
N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide has a molecular weight of 356.86 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide is sourced from PubChem (CID 70670824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).