N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide

C16H22N4O — CID 14664370

IUPACN-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide
SMILESCCN(CC)CCNC(=O)c1ccc(-c2ncc[nH]2)cc1
InChIInChI=1S/C16H22N4O/c1-3-20(4-2)12-11-19-16(21)14-7-5-13(6-8-14)15-17-9-10-18-15/h5-10H,3-4,11-12H2,1-2H3,(H,17,18)(H,19,21)
InChIKeyGRDAOZOYDMVEKO-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.15
Rot. Bonds7

About N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide

N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide (PubChem CID 14664370) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide
PubChem CID14664370
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC NameN-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide
SMILESCCN(CC)CCNC(=O)c1ccc(-c2ncc[nH]2)cc1
InChIInChI=1S/C16H22N4O/c1-3-20(4-2)12-11-19-16(21)14-7-5-13(6-8-14)15-17-9-10-18-15/h5-10H,3-4,11-12H2,1-2H3,(H,17,18)(H,19,21)
InChIKeyGRDAOZOYDMVEKO-UHFFFAOYSA-N
XLogP2.15
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(diethylamino)ethyl]-4-[6-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]pyrimidin-4-yl]benzamide
CID 11081863
N-[2-[ethyl(propyl)amino]ethyl]-4-methylbenzamide
CID 143916034
4-(1H-imidazol-2-yl)-N-(2-thiophen-2-ylethyl)benzamide
CID 110690194
4-tert-butyl-N-[2-(diethylamino)ethyl]benzamide
CID 19165344
N-[2-(diethylamino)ethyl]-4-(dimethylamino)benzamide
CID 47101000
4-acetamido-N-[2-(diethylamino)ethyl]benzamide;hydron;chloride
CID 67108272
1-N,4-N-bis[3-(diethylamino)propyl]benzene-1,4-dicarboxamide
CID 2842708
4-amino-N-[2-(diethylamino)ethyl]benzamide;copper;hydrochloride
CID 70426685
N-[2-(diethylamino)ethyl]-4-(trifluoromethyl)benzamide
CID 3327071
N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-4-phenylbenzamide
CID 17229715
2-(4-chlorophenyl)-N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 108786319
2-amino-N-[2-(diethylamino)ethyl]pyridine-4-carboxamide
CID 62156406

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide (CID 14664370) is N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide is CCN(CC)CCNC(=O)c1ccc(-c2ncc[nH]2)cc1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide?
The InChIKey is GRDAOZOYDMVEKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-3-20(4-2)12-11-19-16(21)14-7-5-13(6-8-14)15-17-9-10-18-15/h5-10H,3-4,11-12H2,1-2H3,(H,17,18)(H,19,21).
What are the key properties of N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide?
N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide has a molecular weight of 286.38 g/mol, XLogP of 2.15, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-4-(1H-imidazol-2-yl)benzamide is sourced from PubChem (CID 14664370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).