2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide

C22H25N3O2 — CID 163397660

IUPAC2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide
SMILESO=C(CC1CCCCC1)Nc1ccc2nc(Cc3cccc(O)c3)[nH]c2c1
InChIInChI=1S/C22H25N3O2/c26-18-8-4-7-16(11-18)12-21-24-19-10-9-17(14-20(19)25-21)23-22(27)13-15-5-2-1-3-6-15/h4,7-11,14-15,26H,1-3,5-6,12-13H2,(H,23,27)(H,24,25)
InChIKeyVOXMOLIWLOSXQQ-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.77
Rot. Bonds5

About 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide

2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide (PubChem CID 163397660) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide
PubChem CID163397660
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC Name2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide
SMILESO=C(CC1CCCCC1)Nc1ccc2nc(Cc3cccc(O)c3)[nH]c2c1
InChIInChI=1S/C22H25N3O2/c26-18-8-4-7-16(11-18)12-21-24-19-10-9-17(14-20(19)25-21)23-22(27)13-15-5-2-1-3-6-15/h4,7-11,14-15,26H,1-3,5-6,12-13H2,(H,23,27)(H,24,25)
InChIKeyVOXMOLIWLOSXQQ-UHFFFAOYSA-N
XLogP4.77
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dimethyl-6-methylidenecyclohexyl)-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide
CID 163397668
N-[3-[2-(1H-benzimidazol-2-yl)ethyl]phenyl]-2-cyclohexylacetamide
CID 20933774
2-cyclohexyl-N-(2-phenyl-3H-benzimidazol-5-yl)acetamide
CID 163397662
2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide
CID 46290733
N-(2-benzyl-3H-benzimidazol-5-yl)-2-[(1,1-dioxothiolan-3-yl)-methylamino]acetamide
CID 46977451
N-(2-benzyl-3H-benzimidazol-5-yl)-2-[[(3S)-1,1-dioxothiolan-3-yl]-methylamino]acetamide
CID 92626778
2-cyclopentyl-N-(1H-indazol-6-yl)acetamide
CID 47110222
N-[3-(bromomethyl)phenyl]-2-cyclopentylacetamide
CID 114307300
3-[(2-cycloheptylacetyl)amino]benzoic acid
CID 115909872
N-[2-(methoxymethyl)-3H-benzimidazol-5-yl]-2-phenylacetamide
CID 51044165
2-cyclopentyl-N-[2-[[2-(3-hydroxyphenyl)acetyl]amino]ethyl]acetamide
CID 98231617
N-[2-(1-hydroxyethyl)-3H-benzimidazol-5-yl]-2-piperidin-4-ylacetamide
CID 131891746

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide?
The IUPAC name of 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide (CID 163397660) is 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide.
What is the SMILES notation for 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide?
The canonical SMILES for 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide is O=C(CC1CCCCC1)Nc1ccc2nc(Cc3cccc(O)c3)[nH]c2c1.
What is the InChIKey of 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide?
The InChIKey is VOXMOLIWLOSXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c26-18-8-4-7-16(11-18)12-21-24-19-10-9-17(14-20(19)25-21)23-22(27)13-15-5-2-1-3-6-15/h4,7-11,14-15,26H,1-3,5-6,12-13H2,(H,23,27)(H,24,25).
What are the key properties of 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide?
2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide has a molecular weight of 363.46 g/mol, XLogP of 4.77, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide is sourced from PubChem (CID 163397660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).