N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide

C22H30N2O3 — CID 20563569

IUPACN-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide
SMILESCCC(Oc1cccc2[nH]c(=O)ccc12)C(=O)N(CC)C1CCCC(C)C1
InChIInChI=1S/C22H30N2O3/c1-4-19(22(26)24(5-2)16-9-6-8-15(3)14-16)27-20-11-7-10-18-17(20)12-13-21(25)23-18/h7,10-13,15-16,19H,4-6,8-9,14H2,1-3H3,(H,23,25)
InChIKeyYYIBNHFAOJGXIG-UHFFFAOYSA-N
MW370.49 g/mol
LogP4.11
Rot. Bonds6

About N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide

N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide (PubChem CID 20563569) has the molecular formula C22H30N2O3 and a molecular weight of 370.49 g/mol. Its IUPAC name is N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide
PubChem CID20563569
Molecular FormulaC22H30N2O3
Molecular Weight370.49 g/mol
Exact Mass370.23
IUPAC NameN-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide
SMILESCCC(Oc1cccc2[nH]c(=O)ccc12)C(=O)N(CC)C1CCCC(C)C1
InChIInChI=1S/C22H30N2O3/c1-4-19(22(26)24(5-2)16-9-6-8-15(3)14-16)27-20-11-7-10-18-17(20)12-13-21(25)23-18/h7,10-13,15-16,19H,4-6,8-9,14H2,1-3H3,(H,23,25)
InChIKeyYYIBNHFAOJGXIG-UHFFFAOYSA-N
XLogP4.11
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.49
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide with MolForge

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Related Compounds

[(2R)-1-[cyclohexyl(ethyl)amino]-1-oxopropan-2-yl] 2-oxo-1H-quinoline-4-carboxylate
CID 8789590
(2R)-N-cyclopentyl-N-methyl-2-(2-methylphenoxy)butanamide
CID 92680266
(2R)-N-methyl-2-naphthalen-1-yloxy-N-phenylbutanamide
CID 38017332
N-cyclohexyl-N-ethyl-2,2-diphenylacetamide
CID 21210383
1-(1H-indol-4-yloxy)-3-[(3-methylcyclohexyl)amino]propan-2-ol
CID 22113437
(2S)-N-cycloheptyl-2-naphthalen-1-yloxybutanamide
CID 30386318
(2R)-2-amino-N-cyclohexyl-N-ethyl-2-phenylacetamide
CID 61148081
cyclohexyl 2-(2-aminophenoxy)butanoate
CID 82027657
N-cyclohexyl-N-ethyl-2,3-dimethoxybenzamide
CID 134010441
N-cyclohexyl-N-methyl-2-[(2-oxo-1H-quinolin-6-yl)oxy]hexanamide
CID 56977684
5-acetyl-1H-quinolin-2-one
CID 13375477
N-[3-[ethyl(methyl)amino]phenyl]-2-(3-methylcyclohexyl)oxypropanamide
CID 86960782

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide?
The IUPAC name of N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide (CID 20563569) is N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide.
What is the SMILES notation for N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide?
The canonical SMILES for N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide is CCC(Oc1cccc2[nH]c(=O)ccc12)C(=O)N(CC)C1CCCC(C)C1.
What is the InChIKey of N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide?
The InChIKey is YYIBNHFAOJGXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O3/c1-4-19(22(26)24(5-2)16-9-6-8-15(3)14-16)27-20-11-7-10-18-17(20)12-13-21(25)23-18/h7,10-13,15-16,19H,4-6,8-9,14H2,1-3H3,(H,23,25).
What are the key properties of N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide?
N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide has a molecular weight of 370.49 g/mol, XLogP of 4.11, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylcyclohexyl)-2-[(2-oxo-1H-quinolin-5-yl)oxy]butanamide is sourced from PubChem (CID 20563569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).