N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide

C20H26N4O4 — CID 135626534

IUPACN-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide
SMILESO=C1CN2Cc3cccc(OCC(=O)N(CCO)C4CCCCC4)c3N=C2N1
InChIInChI=1S/C20H26N4O4/c25-10-9-24(15-6-2-1-3-7-15)18(27)13-28-16-8-4-5-14-11-23-12-17(26)21-20(23)22-19(14)16/h4-5,8,15,25H,1-3,6-7,9-13H2,(H,21,22,26)
InChIKeyVKBCNABSOYETMD-UHFFFAOYSA-N
MW386.45 g/mol
LogP1.15
Rot. Bonds6

About N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide

N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide (PubChem CID 135626534) has the molecular formula C20H26N4O4 and a molecular weight of 386.45 g/mol. Its IUPAC name is N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide
PubChem CID135626534
Molecular FormulaC20H26N4O4
Molecular Weight386.45 g/mol
Exact Mass386.20
IUPAC NameN-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide
SMILESO=C1CN2Cc3cccc(OCC(=O)N(CCO)C4CCCCC4)c3N=C2N1
InChIInChI=1S/C20H26N4O4/c25-10-9-24(15-6-2-1-3-7-15)18(27)13-28-16-8-4-5-14-11-23-12-17(26)21-20(23)22-19(14)16/h4-5,8,15,25H,1-3,6-7,9-13H2,(H,21,22,26)
InChIKeyVKBCNABSOYETMD-UHFFFAOYSA-N
XLogP1.15
TPSA94.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-cyclohexylbutyl)-N-(2-hydroxyethyl)-6-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]hexanamide
CID 135973968
N-cyclohexyl-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]propanamide
CID 135997327
N-methyl-6-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]-N-phenylhexanamide
CID 135626702
N-cyclohexyl-N-(1-hydroxyethyl)-6-[[3-(hydroxymethyl)-2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl]oxy]hexanamide
CID 135626317
N-cyclohexyl-N-(2-hydroxyethyl)-7-[(6-methyl-2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-8-yl)oxy]heptanamide
CID 135626503
N-cyclobutyl-N-(2-hydroxyethyl)-2-phenoxyacetamide
CID 102684381
2-(2-carbamothioylphenoxy)-N-cyclobutyl-N-(2-hydroxyethyl)acetamide
CID 102862530
N-cyclobutyl-2-(2,6-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide
CID 102684292
N-(cyclohexylmethyl)-N-(2-hydroxyethyl)-5-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]pentanamide
CID 135626550
N-(cyclopentylmethyl)-N-(2-hydroxyethyl)-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide
CID 135626766
N-cyclopentyl-N-methyl-4-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide
CID 135626472
N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide
CID 102684250

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide?
The IUPAC name of N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide (CID 135626534) is N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide.
What is the SMILES notation for N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide?
The canonical SMILES for N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide is O=C1CN2Cc3cccc(OCC(=O)N(CCO)C4CCCCC4)c3N=C2N1.
What is the InChIKey of N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide?
The InChIKey is VKBCNABSOYETMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O4/c25-10-9-24(15-6-2-1-3-7-15)18(27)13-28-16-8-4-5-14-11-23-12-17(26)21-20(23)22-19(14)16/h4-5,8,15,25H,1-3,6-7,9-13H2,(H,21,22,26).
What are the key properties of N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide?
N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide has a molecular weight of 386.45 g/mol, XLogP of 1.15, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-(2-hydroxyethyl)-2-[(2-oxo-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-9-yl)oxy]acetamide is sourced from PubChem (CID 135626534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).