2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide

C23H24N4O2 — CID 17463775

IUPAC2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide
SMILESCC(NC(=O)Cn1c(NCCO)nc2ccccc21)c1ccc2ccccc2c1
InChIInChI=1S/C23H24N4O2/c1-16(18-11-10-17-6-2-3-7-19(17)14-18)25-22(29)15-27-21-9-5-4-8-20(21)26-23(27)24-12-13-28/h2-11,14,16,28H,12-13,15H2,1H3,(H,24,26)(H,25,29)
InChIKeyANOQIGKLNUBXSS-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.47
Rot. Bonds7

About 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide

2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide (PubChem CID 17463775) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide
PubChem CID17463775
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide
SMILESCC(NC(=O)Cn1c(NCCO)nc2ccccc21)c1ccc2ccccc2c1
InChIInChI=1S/C23H24N4O2/c1-16(18-11-10-17-6-2-3-7-19(17)14-18)25-22(29)15-27-21-9-5-4-8-20(21)26-23(27)24-12-13-28/h2-11,14,16,28H,12-13,15H2,1H3,(H,24,26)(H,25,29)
InChIKeyANOQIGKLNUBXSS-UHFFFAOYSA-N
XLogP3.47
TPSA79.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1S)-1-naphthalen-2-ylethyl]-2-[4,7,10-tris[2-[[(1S)-1-naphthalen-2-ylethyl]amino]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetamide
CID 102115111
N-[4-(difluoromethoxy)phenyl]-2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]acetamide
CID 51142198
N-[1-(4-chlorophenyl)ethyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
CID 110882950
N-[(4-chlorophenyl)methyl]-2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]acetamide
CID 51142146
1-(3-chlorophenyl)-2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]ethanone;hydrochloride
CID 146052223
4-[[2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]acetyl]amino]-N-methylbenzamide
CID 55503123
2,2-dimethyl-N-[3-(1-naphthalen-2-ylethylamino)-3-oxopropyl]propanamide
CID 18155146
2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-1-piperidin-1-ylethanone
CID 51142185
2-[2-(2-hydroxypropylamino)benzimidazol-1-yl]-N-pentan-3-ylacetamide
CID 42971097
N-[(1R)-1-(4-ethylphenyl)ethyl]-2-(2-methylbenzimidazol-1-yl)acetamide
CID 7755480
1-(4-bromophenyl)-2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]ethanone;hydrobromide
CID 2851199
N-[(1S)-1-naphthalen-2-ylethyl]-2-(tetrazol-1-yl)acetamide
CID 51513287

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide?
The IUPAC name of 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide (CID 17463775) is 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide.
What is the SMILES notation for 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide?
The canonical SMILES for 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide is CC(NC(=O)Cn1c(NCCO)nc2ccccc21)c1ccc2ccccc2c1.
What is the InChIKey of 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide?
The InChIKey is ANOQIGKLNUBXSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-16(18-11-10-17-6-2-3-7-19(17)14-18)25-22(29)15-27-21-9-5-4-8-20(21)26-23(27)24-12-13-28/h2-11,14,16,28H,12-13,15H2,1H3,(H,24,26)(H,25,29).
What are the key properties of 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide?
2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide has a molecular weight of 388.47 g/mol, XLogP of 3.47, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-(1-naphthalen-2-ylethyl)acetamide is sourced from PubChem (CID 17463775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).