N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide

C18H19FN4O — CID 53143754

IUPACN-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide
SMILESCCn1c(CCNC(=O)Cc2cccc(F)c2)nc2cccnc21
InChIInChI=1S/C18H19FN4O/c1-2-23-16(22-15-7-4-9-21-18(15)23)8-10-20-17(24)12-13-5-3-6-14(19)11-13/h3-7,9,11H,2,8,10,12H2,1H3,(H,20,24)
InChIKeyMSXZUZVJYVGGAG-UHFFFAOYSA-N
MW326.38 g/mol
LogP2.49
Rot. Bonds6

About N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide

N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide (PubChem CID 53143754) has the molecular formula C18H19FN4O and a molecular weight of 326.38 g/mol. Its IUPAC name is N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide
PubChem CID53143754
Molecular FormulaC18H19FN4O
Molecular Weight326.38 g/mol
Exact Mass326.15
IUPAC NameN-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide
SMILESCCn1c(CCNC(=O)Cc2cccc(F)c2)nc2cccnc21
InChIInChI=1S/C18H19FN4O/c1-2-23-16(22-15-7-4-9-21-18(15)23)8-10-20-17(24)12-13-5-3-6-14(19)11-13/h3-7,9,11H,2,8,10,12H2,1H3,(H,20,24)
InChIKeyMSXZUZVJYVGGAG-UHFFFAOYSA-N
XLogP2.49
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-3-fluorobenzamide
CID 71842734
2-(3-fluorophenyl)-N-[2-(2-phenylimidazo[4,5-b]pyridin-3-yl)ethyl]acetamide
CID 53020252
2-(3-methoxyphenyl)-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]acetamide
CID 53143714
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide
CID 53143755
2-(3-fluorophenyl)-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide
CID 110712309
2-(3-fluorophenyl)-N-[2-(1-propylpyrrolo[2,3-b]pyridin-3-yl)ethyl]acetamide
CID 53145109
(3R)-3-[(3-ethylimidazo[4,5-b]pyridin-2-yl)methyl]-N-[(3-fluorophenyl)methyl]pyrrolidine-1-carboxamide
CID 95112504
N-[(3-fluorophenyl)methyl]-3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]propanamide
CID 122445601
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide
CID 53143748
3-ethyl-2-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridine
CID 117165475
2-[(3-fluorophenyl)methyl]-3-(2-methoxyethyl)imidazo[4,5-b]pyridine
CID 117164895
3-(3-fluorophenyl)-N-[2-(1-methylbenzimidazol-2-yl)ethyl]propanamide
CID 110711966

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide?
The IUPAC name of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide (CID 53143754) is N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide.
What is the SMILES notation for N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide?
The canonical SMILES for N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide is CCn1c(CCNC(=O)Cc2cccc(F)c2)nc2cccnc21.
What is the InChIKey of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide?
The InChIKey is MSXZUZVJYVGGAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN4O/c1-2-23-16(22-15-7-4-9-21-18(15)23)8-10-20-17(24)12-13-5-3-6-14(19)11-13/h3-7,9,11H,2,8,10,12H2,1H3,(H,20,24).
What are the key properties of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide?
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide has a molecular weight of 326.38 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide is sourced from PubChem (CID 53143754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).