N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide

C20H30N4O2 — CID 118697366

IUPACN-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide
SMILESCc1ccc2nc(NC(=O)C(C)(C)COC(C)(C)C)n(C3CCC3)c2n1
InChIInChI=1S/C20H30N4O2/c1-13-10-11-15-16(21-13)24(14-8-7-9-14)18(22-15)23-17(25)20(5,6)12-26-19(2,3)4/h10-11,14H,7-9,12H2,1-6H3,(H,22,23,25)
InChIKeyVATBCPCFGOAZQL-UHFFFAOYSA-N
MW358.49 g/mol
LogP4.24
Rot. Bonds5

About N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide

N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide (PubChem CID 118697366) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide.

Molecular Properties

Compound NameN-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide
PubChem CID118697366
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC NameN-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide
SMILESCc1ccc2nc(NC(=O)C(C)(C)COC(C)(C)C)n(C3CCC3)c2n1
InChIInChI=1S/C20H30N4O2/c1-13-10-11-15-16(21-13)24(14-8-7-9-14)18(22-15)23-17(25)20(5,6)12-26-19(2,3)4/h10-11,14H,7-9,12H2,1-6H3,(H,22,23,25)
InChIKeyVATBCPCFGOAZQL-UHFFFAOYSA-N
XLogP4.24
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide?
The IUPAC name of N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide (CID 118697366) is N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide.
What is the SMILES notation for N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide?
The canonical SMILES for N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide is Cc1ccc2nc(NC(=O)C(C)(C)COC(C)(C)C)n(C3CCC3)c2n1.
What is the InChIKey of N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide?
The InChIKey is VATBCPCFGOAZQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2/c1-13-10-11-15-16(21-13)24(14-8-7-9-14)18(22-15)23-17(25)20(5,6)12-26-19(2,3)4/h10-11,14H,7-9,12H2,1-6H3,(H,22,23,25).
What are the key properties of N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide?
N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide has a molecular weight of 358.49 g/mol, XLogP of 4.24, 5 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)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propanamide is sourced from PubChem (CID 118697366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).