4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide

C24H32N4O — CID 16759221

IUPAC4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide
SMILESCCN(CC)CCCC(C)NC(=O)c1ccc(Cc2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C24H32N4O/c1-4-28(5-2)16-8-9-18(3)25-24(29)20-14-12-19(13-15-20)17-23-26-21-10-6-7-11-22(21)27-23/h6-7,10-15,18H,4-5,8-9,16-17H2,1-3H3,(H,25,29)(H,26,27)
InChIKeyISDYYOFUDCLEPC-UHFFFAOYSA-N
MW392.55 g/mol
LogP4.39
Rot. Bonds10

About 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide

4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide (PubChem CID 16759221) has the molecular formula C24H32N4O and a molecular weight of 392.55 g/mol. Its IUPAC name is 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide.

Molecular Properties

Compound Name4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide
PubChem CID16759221
Molecular FormulaC24H32N4O
Molecular Weight392.55 g/mol
Exact Mass392.26
IUPAC Name4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide
SMILESCCN(CC)CCCC(C)NC(=O)c1ccc(Cc2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C24H32N4O/c1-4-28(5-2)16-8-9-18(3)25-24(29)20-14-12-19(13-15-20)17-23-26-21-10-6-7-11-22(21)27-23/h6-7,10-15,18H,4-5,8-9,16-17H2,1-3H3,(H,25,29)(H,26,27)
InChIKeyISDYYOFUDCLEPC-UHFFFAOYSA-N
XLogP4.39
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.55
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(1H-benzimidazol-2-ylmethyl)phenoxy]-N,N-diethylethanamine
CID 141216936
N-[5-(diethylamino)pentan-2-yl]-4-(trifluoromethyl)benzamide
CID 4535202
4-cyano-N-[5-(diethylamino)pentan-2-yl]benzamide
CID 24708648
4-(1H-benzimidazol-2-yl)-N-(6-methylheptan-2-yl)butanamide
CID 46411057
N-[1-[3-(1H-benzimidazol-2-yl)propyl-methylamino]-1-oxopropan-2-yl]benzamide
CID 86859963
6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
CID 38988276
6-amino-N-[5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
CID 62153221
2-[(4-methylphenyl)methyl]-1H-benzimidazole
CID 772158
4-[[[N-[5-(diethylamino)pentan-2-yl]-N'-methylcarbamimidoyl]amino]methyl]-N-methylbenzamide;hydroiodide
CID 110997582
4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2-(diethylamino)ethyl]benzamide
CID 30550229
N-[5-(diethylamino)pentan-2-yl]-4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]benzamide
CID 6411699
N-[2-(1H-benzimidazol-2-yl)ethyl]-N',N'-diethylpropane-1,3-diamine
CID 82337057

Frequently Asked Questions

What is the IUPAC name of 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide?
The IUPAC name of 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide (CID 16759221) is 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide.
What is the SMILES notation for 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide?
The canonical SMILES for 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide is CCN(CC)CCCC(C)NC(=O)c1ccc(Cc2nc3ccccc3[nH]2)cc1.
What is the InChIKey of 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide?
The InChIKey is ISDYYOFUDCLEPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N4O/c1-4-28(5-2)16-8-9-18(3)25-24(29)20-14-12-19(13-15-20)17-23-26-21-10-6-7-11-22(21)27-23/h6-7,10-15,18H,4-5,8-9,16-17H2,1-3H3,(H,25,29)(H,26,27).
What are the key properties of 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide?
4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide has a molecular weight of 392.55 g/mol, XLogP of 4.39, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-benzimidazol-2-ylmethyl)-N-[5-(diethylamino)pentan-2-yl]benzamide is sourced from PubChem (CID 16759221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).