2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide

C21H29N3O — CID 856407

IUPAC2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide
SMILESO=C(Cn1cnc2ccccc21)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H29N3O/c25-21(15-23-16-22-19-13-7-8-14-20(19)23)24(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h7-8,13-14,16-18H,1-6,9-12,15H2
InChIKeyZFURTMNZGJUMGL-UHFFFAOYSA-N
MW339.48 g/mol
LogP4.53
Rot. Bonds4

About 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide

2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide (PubChem CID 856407) has the molecular formula C21H29N3O and a molecular weight of 339.48 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide
PubChem CID856407
Molecular FormulaC21H29N3O
Molecular Weight339.48 g/mol
Exact Mass339.23
IUPAC Name2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide
SMILESO=C(Cn1cnc2ccccc21)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H29N3O/c25-21(15-23-16-22-19-13-7-8-14-20(19)23)24(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h7-8,13-14,16-18H,1-6,9-12,15H2
InChIKeyZFURTMNZGJUMGL-UHFFFAOYSA-N
XLogP4.53
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.48
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzimidazol-1-yl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide
CID 146123330
2-(N-[2-(benzimidazol-1-yl)acetyl]anilino)-N-cyclohexyl-2-phenylacetamide
CID 3202307
2-(benzimidazol-1-yl)-N-cyclopropyl-N-(thiophen-2-ylmethyl)acetamide
CID 91641807
N,N-dicyclohexyl-2-(6-methyl-4-oxoquinazolin-3-yl)acetamide
CID 46484188
N,N-dicyclohexyl-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 16997064
2-(benzimidazol-1-yl)-N-benzyl-N-(oxetan-3-yl)acetamide
CID 166259805
4-(benzimidazol-1-ylmethyl)cyclohexane-1-carboxylic acid
CID 172582070
N,N-dicyclohexyl-2-[2-(oxolan-2-yl)benzimidazol-1-yl]acetamide
CID 17000129
N-cyclopentyl-N-cyclopropyl-2-(2-oxo-1-pyridinyl)acetamide
CID 75414353
N,N-dicyclohexyl-2-[2-(6-methyl-3-pyridinyl)benzimidazol-1-yl]acetamide
CID 175290062
N-(3-aminopropyl)-2-(benzimidazol-1-yl)-N-methylacetamide
CID 43253838
[2-(cyclohexylmethylamino)-2-oxoethyl] 2-(benzimidazol-1-yl)acetate
CID 5035462

Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide (CID 856407) is 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide is O=C(Cn1cnc2ccccc21)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide?
The InChIKey is ZFURTMNZGJUMGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O/c25-21(15-23-16-22-19-13-7-8-14-20(19)23)24(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h7-8,13-14,16-18H,1-6,9-12,15H2.
What are the key properties of 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide?
2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide has a molecular weight of 339.48 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide is sourced from PubChem (CID 856407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).