ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide

C16H24N4O2 — CID 156795295

IUPACethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide
SMILESCC.CCc1cccn2c(N(C)CCC(=O)NC=O)cnc12
InChIInChI=1S/C14H18N4O2.C2H6/c1-3-11-5-4-7-18-13(9-15-14(11)18)17(2)8-6-12(20)16-10-19;1-2/h4-5,7,9-10H,3,6,8H2,1-2H3,(H,16,19,20);1-2H3
InChIKeyBDJLYJCITOFPNN-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.02
Rot. Bonds6

About ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide

ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide (PubChem CID 156795295) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide.

Molecular Properties

Compound Nameethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide
PubChem CID156795295
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Nameethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide
SMILESCC.CCc1cccn2c(N(C)CCC(=O)NC=O)cnc12
InChIInChI=1S/C14H18N4O2.C2H6/c1-3-11-5-4-7-18-13(9-15-14(11)18)17(2)8-6-12(20)16-10-19;1-2/h4-5,7,9-10H,3,6,8H2,1-2H3,(H,16,19,20);1-2H3
InChIKeyBDJLYJCITOFPNN-UHFFFAOYSA-N
XLogP2.02
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide
CID 176558070
3-[(3-iodoimidazo[1,2-a]pyridin-8-yl)methyl-methylamino]propan-1-ol
CID 167903552
3-[(6-amino-5-fluoro-1-methylindazol-3-yl)-methylamino]-N-formylpropanamide
CID 177160550
2-(3-ethylphenyl)-N-formylacetamide
CID 130010349
ethane;1-(8-ethylimidazo[1,2-a]pyridin-3-yl)-1,3-diazinane-2,4-dione
CID 156795368
3-[2-(ethylaminomethyl)-N-methylanilino]-N-methylpropanamide
CID 106916760
2-(9-amino-4-oxopyrido[1,2-a]pyrimidin-3-yl)acetic acid
CID 115031157
2-(3-ethylimidazo[1,5-a]pyridin-8-yl)acetic acid
CID 83832478
3-[[5-(hydroxymethyl)pyrimidin-2-yl]-methylamino]-N-methylpropanamide
CID 106916351
3-(3-chloroimidazo[1,2-a]pyridin-8-yl)-2-methylpropanoic acid
CID 83842801
2-ethyl-1,3-difluorobenzene;N-formylpentanamide
CID 176933071
4-(2,6-diethyl-N-methylanilino)butan-2-one
CID 117029527

Frequently Asked Questions

What is the IUPAC name of ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide?
The IUPAC name of ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide (CID 156795295) is ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide.
What is the SMILES notation for ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide?
The canonical SMILES for ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide is CC.CCc1cccn2c(N(C)CCC(=O)NC=O)cnc12.
What is the InChIKey of ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide?
The InChIKey is BDJLYJCITOFPNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2.C2H6/c1-3-11-5-4-7-18-13(9-15-14(11)18)17(2)8-6-12(20)16-10-19;1-2/h4-5,7,9-10H,3,6,8H2,1-2H3,(H,16,19,20);1-2H3.
What are the key properties of ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide?
ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide has a molecular weight of 304.39 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-[(8-ethylimidazo[1,2-a]pyridin-3-yl)-methylamino]-N-formylpropanamide is sourced from PubChem (CID 156795295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).