N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide

C16H22N4O2 — CID 118697340

IUPACN-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide
SMILESCCOCCC(=O)Nc1nc2ccc(C)nc2n1C1CCC1
InChIInChI=1S/C16H22N4O2/c1-3-22-10-9-14(21)19-16-18-13-8-7-11(2)17-15(13)20(16)12-5-4-6-12/h7-8,12H,3-6,9-10H2,1-2H3,(H,18,19,21)
InChIKeyZFRZVDDLOIMOEU-UHFFFAOYSA-N
MW302.38 g/mol
LogP2.83
Rot. Bonds6

About N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide

N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide (PubChem CID 118697340) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide.

Molecular Properties

Compound NameN-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide
PubChem CID118697340
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC NameN-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide
SMILESCCOCCC(=O)Nc1nc2ccc(C)nc2n1C1CCC1
InChIInChI=1S/C16H22N4O2/c1-3-22-10-9-14(21)19-16-18-13-8-7-11(2)17-15(13)20(16)12-5-4-6-12/h7-8,12H,3-6,9-10H2,1-2H3,(H,18,19,21)
InChIKeyZFRZVDDLOIMOEU-UHFFFAOYSA-N
XLogP2.83
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-propan-2-yloxypropanamide;methane
CID 159774443
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-4-methoxy-4-methylpentanamide;methane
CID 161374372
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-cyclopentylacetamide
CID 118697273
N-[3-cyclobutyl-5-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]-3-(2,2,2-trifluoroethoxy)propanamide
CID 90447971
(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-cyclopropyl-3-hydroxybutanamide
CID 130359765
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2-dimethylcyclopropyl)acetamide;methane
CID 159980573
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide
CID 118697366
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,2,3,3-tetrafluorocyclobutyl)acetamide;methane
CID 157256627
2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide
CID 118697357
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(2S)-5,5-dimethyloxolan-2-yl]acetamide;methane
CID 159448450
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-[(1R)-5-methyl-2-oxabicyclo[3.2.0]heptan-7-yl]acetamide
CID 118697388
[3-cyclobutyl-2-(3,3-dimethylbutanoylamino)imidazo[4,5-b]pyridin-5-yl]carbamic acid
CID 118692468

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide?
The IUPAC name of N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide (CID 118697340) is N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide.
What is the SMILES notation for N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide?
The canonical SMILES for N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide is CCOCCC(=O)Nc1nc2ccc(C)nc2n1C1CCC1.
What is the InChIKey of N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide?
The InChIKey is ZFRZVDDLOIMOEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-3-22-10-9-14(21)19-16-18-13-8-7-11(2)17-15(13)20(16)12-5-4-6-12/h7-8,12H,3-6,9-10H2,1-2H3,(H,18,19,21).
What are the key properties of N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide?
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide has a molecular weight of 302.38 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-ethoxypropanamide is sourced from PubChem (CID 118697340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).