N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide

C25H28N4O2 — CID 43822189

IUPACN-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCC(=O)N(c1ccc(N2CCOCC2)cc1)c1c(C2CC=CCC2)nc2ccccn12
InChIInChI=1S/C25H28N4O2/c1-19(30)29(22-12-10-21(11-13-22)27-15-17-31-18-16-27)25-24(20-7-3-2-4-8-20)26-23-9-5-6-14-28(23)25/h2-3,5-6,9-14,20H,4,7-8,15-18H2,1H3
InChIKeyQFPULBVNFKWNAY-UHFFFAOYSA-N
MW416.53 g/mol
LogP4.68
Rot. Bonds4

About N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide

N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 43822189) has the molecular formula C25H28N4O2 and a molecular weight of 416.53 g/mol. Its IUPAC name is N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide
PubChem CID43822189
Molecular FormulaC25H28N4O2
Molecular Weight416.53 g/mol
Exact Mass416.22
IUPAC NameN-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCC(=O)N(c1ccc(N2CCOCC2)cc1)c1c(C2CC=CCC2)nc2ccccn12
InChIInChI=1S/C25H28N4O2/c1-19(30)29(22-12-10-21(11-13-22)27-15-17-31-18-16-27)25-24(20-7-3-2-4-8-20)26-23-9-5-6-14-28(23)25/h2-3,5-6,9-14,20H,4,7-8,15-18H2,1H3
InChIKeyQFPULBVNFKWNAY-UHFFFAOYSA-N
XLogP4.68
TPSA50.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.53
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide
CID 1495394
N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-[4-(dimethylamino)phenyl]formamide
CID 43822147
N-[4-(dimethylamino)phenyl]-N-(2-ethylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 1495259
[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone
CID 101130657
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]benzamide
CID 134009668
N-(5-morpholin-4-yl-2-pyridinyl)-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 136548016
N,N-dimethyl-4-morpholin-4-ylaniline
CID 11264229
[4-[4-chloro-3-(3-methylimidazo[1,2-a]pyridin-2-yl)phenyl]piperazin-1-yl]-(oxan-4-yl)methanone
CID 138515677
(2R)-N-(4-morpholin-4-ylphenyl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)propanamide
CID 2474766
[3-[3-(tert-butylamino)imidazo[1,2-a]pyridin-2-yl]piperidin-1-yl]-(oxan-4-yl)methanone
CID 110223764
1-[4-[4-(4-morpholin-4-ylphenyl)piperazin-1-yl]phenyl]ethanone
CID 20729332
(1S)-N-(3-chloro-2-morpholin-4-ylphenyl)cyclohex-3-ene-1-carboxamide
CID 25347228

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide (CID 43822189) is N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide is CC(=O)N(c1ccc(N2CCOCC2)cc1)c1c(C2CC=CCC2)nc2ccccn12.
What is the InChIKey of N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is QFPULBVNFKWNAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N4O2/c1-19(30)29(22-12-10-21(11-13-22)27-15-17-31-18-16-27)25-24(20-7-3-2-4-8-20)26-23-9-5-6-14-28(23)25/h2-3,5-6,9-14,20H,4,7-8,15-18H2,1H3.
What are the key properties of N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide?
N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 416.53 g/mol, XLogP of 4.68, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridin-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 43822189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).