N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide

C20H28N4O — CID 56789513

IUPACN-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide
SMILESCN(C)CCN(C(=O)c1ccc(Cn2ccnc2)cc1)C1CCCC1
InChIInChI=1S/C20H28N4O/c1-22(2)13-14-24(19-5-3-4-6-19)20(25)18-9-7-17(8-10-18)15-23-12-11-21-16-23/h7-12,16,19H,3-6,13-15H2,1-2H3
InChIKeyZIRJIHHSSFNKFJ-UHFFFAOYSA-N
MW340.47 g/mol
LogP2.88
Rot. Bonds7

About N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide

N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide (PubChem CID 56789513) has the molecular formula C20H28N4O and a molecular weight of 340.47 g/mol. Its IUPAC name is N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide
PubChem CID56789513
Molecular FormulaC20H28N4O
Molecular Weight340.47 g/mol
Exact Mass340.23
IUPAC NameN-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide
SMILESCN(C)CCN(C(=O)c1ccc(Cn2ccnc2)cc1)C1CCCC1
InChIInChI=1S/C20H28N4O/c1-22(2)13-14-24(19-5-3-4-6-19)20(25)18-9-7-17(8-10-18)15-23-12-11-21-16-23/h7-12,16,19H,3-6,13-15H2,1-2H3
InChIKeyZIRJIHHSSFNKFJ-UHFFFAOYSA-N
XLogP2.88
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide
CID 46774109
N-cyclohexyl-N-[2-(dimethylamino)ethyl]-4-pyridin-4-ylbenzamide
CID 119070496
N-cyclopentyl-4-(imidazol-1-ylmethyl)benzamide
CID 43918576
N-(2-cyclohexylsulfanylethyl)-4-(imidazol-1-ylmethyl)benzamide
CID 43922951
3-cyclopentyl-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]propanamide
CID 37426831
[4-(imidazol-1-ylmethyl)phenyl]-[(3R)-3-methylpiperidin-1-yl]methanone
CID 94022564
4-(imidazol-1-ylmethyl)benzoate
CID 42555847
4-(imidazol-1-ylmethyl)-N-propan-2-ylbenzamide
CID 43918416
4-bromo-3-chloro-N-cyclopentyl-N-[2-(dimethylamino)ethyl]benzamide
CID 80999167
N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide
CID 60565522
4-(imidazol-1-ylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 93491347
(4-hydroxyphenyl)-[4-(imidazol-1-ylmethyl)phenyl]methanone
CID 171357643

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide?
The IUPAC name of N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide (CID 56789513) is N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide.
What is the SMILES notation for N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide?
The canonical SMILES for N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide is CN(C)CCN(C(=O)c1ccc(Cn2ccnc2)cc1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide?
The InChIKey is ZIRJIHHSSFNKFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O/c1-22(2)13-14-24(19-5-3-4-6-19)20(25)18-9-7-17(8-10-18)15-23-12-11-21-16-23/h7-12,16,19H,3-6,13-15H2,1-2H3.
What are the key properties of N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide?
N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide has a molecular weight of 340.47 g/mol, XLogP of 2.88, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-(imidazol-1-ylmethyl)benzamide is sourced from PubChem (CID 56789513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).