N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide

C15H22N4O — CID 110225703

IUPACN-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide
SMILESCCn1c(C(CC(C)C)NC(C)=O)nc2cccnc21
InChIInChI=1S/C15H22N4O/c1-5-19-14-12(7-6-8-16-14)18-15(19)13(9-10(2)3)17-11(4)20/h6-8,10,13H,5,9H2,1-4H3,(H,17,20)
InChIKeyJYRPRRQOJMRSJW-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.67
Rot. Bonds5

About N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide

N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide (PubChem CID 110225703) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide.

Molecular Properties

Compound NameN-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide
PubChem CID110225703
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide
SMILESCCn1c(C(CC(C)C)NC(C)=O)nc2cccnc21
InChIInChI=1S/C15H22N4O/c1-5-19-14-12(7-6-8-16-14)18-15(19)13(9-10(2)3)17-11(4)20/h6-8,10,13H,5,9H2,1-4H3,(H,17,20)
InChIKeyJYRPRRQOJMRSJW-UHFFFAOYSA-N
XLogP2.67
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]cyclopropanecarboxamide
CID 16674902
N-[(1R)-1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]-4-methoxycyclohexane-1-carboxamide
CID 98066361
N-[1-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethyl]acetamide
CID 110225702
2-(4-methoxyphenyl)-N-[3-methyl-1-(3-methylimidazo[4,5-b]pyridin-2-yl)butyl]acetamide
CID 110219032
ethyl 2-(3-ethylimidazo[4,5-b]pyridin-2-yl)pentanoate
CID 79474968
1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylbutan-1-amine
CID 63758341
2-(2-fluorophenyl)-N-[3-methyl-1-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)butyl]acetamide
CID 16668541
2-methoxy-N-[3-methyl-1-(3-methylimidazo[4,5-b]pyridin-2-yl)butyl]benzamide
CID 16667882
methyl 3-ethylimidazo[4,5-b]pyridine-2-carboxylate
CID 112617607
3-ethyl-2-methylimidazo[4,5-b]pyridine
CID 23298284
3-(2-methylpropyl)imidazo[4,5-b]pyridine-2-carboxylic acid
CID 84684642
2-(3-ethylimidazo[4,5-b]pyridin-2-yl)-4,4-dimethylpentan-1-amine
CID 107473033

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide?
The IUPAC name of N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide (CID 110225703) is N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide.
What is the SMILES notation for N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide?
The canonical SMILES for N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide is CCn1c(C(CC(C)C)NC(C)=O)nc2cccnc21.
What is the InChIKey of N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide?
The InChIKey is JYRPRRQOJMRSJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-5-19-14-12(7-6-8-16-14)18-15(19)13(9-10(2)3)17-11(4)20/h6-8,10,13H,5,9H2,1-4H3,(H,17,20).
What are the key properties of N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide?
N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide has a molecular weight of 274.37 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-3-methylbutyl]acetamide is sourced from PubChem (CID 110225703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).