2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide

C15H19N3O3 — CID 111432174

IUPAC2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
SMILESO=C(CC1(O)CCCCC1)Nc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C15H19N3O3/c19-13(9-15(21)6-2-1-3-7-15)16-10-4-5-11-12(8-10)18-14(20)17-11/h4-5,8,21H,1-3,6-7,9H2,(H,16,19)(H2,17,18,20)
InChIKeyKHCNZCSQHWFFNA-UHFFFAOYSA-N
MW289.33 g/mol
LogP1.88
Rot. Bonds3

About 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide

2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide (PubChem CID 111432174) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
PubChem CID111432174
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
SMILESO=C(CC1(O)CCCCC1)Nc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C15H19N3O3/c19-13(9-15(21)6-2-1-3-7-15)16-10-4-5-11-12(8-10)18-14(20)17-11/h4-5,8,21H,1-3,6-7,9H2,(H,16,19)(H2,17,18,20)
InChIKeyKHCNZCSQHWFFNA-UHFFFAOYSA-N
XLogP1.88
TPSA97.98 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 51.88
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

1-(hydroxymethyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)cyclopropane-1-carboxamide
CID 115182055
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-pyrrolidin-2-ylacetamide
CID 61370404
2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide
CID 111432130
N-(3-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide
CID 111430420
2-tert-butylsulfanyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 34828406
2-(2-bicyclo[2.2.1]heptanyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 42904819
N-(5-acetamido-2-fluorophenyl)-2-(1-hydroxycyclohexyl)acetamide
CID 111331778
2-morpholin-4-yl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 4975216
3-(4-fluorophenyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
CID 18160949
2-(2,6-dichlorophenyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 18103957
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-phenylsulfanylacetamide
CID 6459618
N-[5-[[2-(1-hydroxycyclopentyl)acetyl]amino]-2-methylphenyl]-2,2-dimethylpropanamide
CID 111538466

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide?
The IUPAC name of 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide (CID 111432174) is 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide.
What is the SMILES notation for 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide?
The canonical SMILES for 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide is O=C(CC1(O)CCCCC1)Nc1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide?
The InChIKey is KHCNZCSQHWFFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c19-13(9-15(21)6-2-1-3-7-15)16-10-4-5-11-12(8-10)18-14(20)17-11/h4-5,8,21H,1-3,6-7,9H2,(H,16,19)(H2,17,18,20).
What are the key properties of 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide?
2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide has a molecular weight of 289.33 g/mol, XLogP of 1.88, 3 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclohexyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide is sourced from PubChem (CID 111432174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).