N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide

C14H19N3O — CID 70450400

IUPACN-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide
SMILESCCc1cccc(CC)c1C(=O)NC1=NCCN1
InChIInChI=1S/C14H19N3O/c1-3-10-6-5-7-11(4-2)12(10)13(18)17-14-15-8-9-16-14/h5-7H,3-4,8-9H2,1-2H3,(H2,15,16,17,18)
InChIKeyBENSLLDYVPMWAC-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.50
Rot. Bonds3

About N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide

N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide (PubChem CID 70450400) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide.

Molecular Properties

Compound NameN-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide
PubChem CID70450400
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC NameN-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide
SMILESCCc1cccc(CC)c1C(=O)NC1=NCCN1
InChIInChI=1S/C14H19N3O/c1-3-10-6-5-7-11(4-2)12(10)13(18)17-14-15-8-9-16-14/h5-7H,3-4,8-9H2,1-2H3,(H2,15,16,17,18)
InChIKeyBENSLLDYVPMWAC-UHFFFAOYSA-N
XLogP1.50
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylnaphthalen-1-yl)-4,5-dihydro-1H-imidazol-2-amine
CID 22401591
N-(4,5-dihydro-1H-imidazol-2-yl)-5-hydroxy-2-isocyano-3-phenylpyridine-4-carboxamide
CID 162247203
N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine;ethanol
CID 122517146
2-(2-chloro-3-methoxyphenyl)-3-cyano-N-(4,5-dihydro-1H-imidazol-2-yl)-6-hydroxybenzamide
CID 146507961
1-N,3-N-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,3-dicarboxamide;dihydrochloride
CID 131880352
4-anilino-N-(1,4,5,6-tetrahydropyrimidin-2-yl)benzamide;butane;ethane;methane
CID 167576537
1-(4,5-dihydro-1H-imidazol-2-ylamino)propan-2-one
CID 142858674
6-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid;ethane
CID 91263534
bis(4-N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzene-1,4-diamine);tetrahydrochloride
CID 70450555
2-[(2-ethyl-6-methylphenyl)methyl]-4,5-dihydro-1H-imidazole
CID 24781717
1-(2,6-diethylphenyl)ethanone
CID 14939611
diethyl 2-amino-6-[2-[4,5-dihydro-1H-imidazol-2-ylcarbamoyl(methoxy)amino]-2-oxoethyl]azulene-1,3-dicarboxylate
CID 23296766

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide?
The IUPAC name of N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide (CID 70450400) is N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide.
What is the SMILES notation for N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide?
The canonical SMILES for N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide is CCc1cccc(CC)c1C(=O)NC1=NCCN1.
What is the InChIKey of N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide?
The InChIKey is BENSLLDYVPMWAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-3-10-6-5-7-11(4-2)12(10)13(18)17-14-15-8-9-16-14/h5-7H,3-4,8-9H2,1-2H3,(H2,15,16,17,18).
What are the key properties of N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide?
N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide has a molecular weight of 245.33 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dihydro-1H-imidazol-2-yl)-2,6-diethylbenzamide is sourced from PubChem (CID 70450400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).