N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide

C18H24FN3O2 — CID 136566840

IUPACN-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide
SMILESCC1(C)CCC(CCNC(=O)Cc2cn3cc(F)ccc3n2)OC1
InChIInChI=1S/C18H24FN3O2/c1-18(2)7-5-15(24-12-18)6-8-20-17(23)9-14-11-22-10-13(19)3-4-16(22)21-14/h3-4,10-11,15H,5-9,12H2,1-2H3,(H,20,23)
InChIKeyPQHPLFIISIWLEZ-UHFFFAOYSA-N
MW333.41 g/mol
LogP2.73
Rot. Bonds5

About N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide

N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide (PubChem CID 136566840) has the molecular formula C18H24FN3O2 and a molecular weight of 333.41 g/mol. Its IUPAC name is N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide.

Molecular Properties

Compound NameN-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide
PubChem CID136566840
Molecular FormulaC18H24FN3O2
Molecular Weight333.41 g/mol
Exact Mass333.19
IUPAC NameN-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide
SMILESCC1(C)CCC(CCNC(=O)Cc2cn3cc(F)ccc3n2)OC1
InChIInChI=1S/C18H24FN3O2/c1-18(2)7-5-15(24-12-18)6-8-20-17(23)9-14-11-22-10-13(19)3-4-16(22)21-14/h3-4,10-11,15H,5-9,12H2,1-2H3,(H,20,23)
InChIKeyPQHPLFIISIWLEZ-UHFFFAOYSA-N
XLogP2.73
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6-fluoroimidazo[1,2-a]pyridin-2-yl)propan-2-one
CID 135396946
2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N-(5-piperidin-4-yl-1H-1,2,4-triazol-3-yl)acetamide
CID 166363051
N-(3-cyanophenyl)-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide
CID 53014432
N-(2-aminoethyl)-2-(6-bromoimidazo[1,2-a]pyridin-2-yl)acetamide
CID 39161966
N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-fluorobenzamide
CID 110671973
N-[(2,4-difluorophenyl)methyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 87051416
N-[2-(2,6-difluorophenyl)ethyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 87006920
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2,5-difluoroaniline
CID 78914191
N-[2-(6-chloroimidazo[1,2-a]pyridin-2-yl)ethyl]-2-(4-chlorophenyl)acetamide
CID 110671985
N-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-5-fluoro-4-oxochromene-2-carboxamide
CID 155167645
5-fluoro-N'-(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)-2-methylbenzohydrazide
CID 17411234
2-(3-fluorophenyl)-N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]acetamide
CID 110716952

Frequently Asked Questions

What is the IUPAC name of N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide?
The IUPAC name of N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide (CID 136566840) is N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide.
What is the SMILES notation for N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide?
The canonical SMILES for N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide is CC1(C)CCC(CCNC(=O)Cc2cn3cc(F)ccc3n2)OC1.
What is the InChIKey of N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide?
The InChIKey is PQHPLFIISIWLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FN3O2/c1-18(2)7-5-15(24-12-18)6-8-20-17(23)9-14-11-22-10-13(19)3-4-16(22)21-14/h3-4,10-11,15H,5-9,12H2,1-2H3,(H,20,23).
What are the key properties of N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide?
N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide has a molecular weight of 333.41 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5,5-dimethyloxan-2-yl)ethyl]-2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)acetamide is sourced from PubChem (CID 136566840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).