N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide

C20H24N4O — CID 24747027

IUPACN-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide
SMILESCc1nc2c(cc1NC(=O)C(C)(C)C)nc(C)n2Cc1ccccc1
InChIInChI=1S/C20H24N4O/c1-13-16(23-19(25)20(3,4)5)11-17-18(21-13)24(14(2)22-17)12-15-9-7-6-8-10-15/h6-11H,12H2,1-5H3,(H,23,25)
InChIKeySXZGHGRMWVKECO-UHFFFAOYSA-N
MW336.44 g/mol
LogP4.08
Rot. Bonds3

About N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide

N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide (PubChem CID 24747027) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide
PubChem CID24747027
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC NameN-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide
SMILESCc1nc2c(cc1NC(=O)C(C)(C)C)nc(C)n2Cc1ccccc1
InChIInChI=1S/C20H24N4O/c1-13-16(23-19(25)20(3,4)5)11-17-18(21-13)24(14(2)22-17)12-15-9-7-6-8-10-15/h6-11H,12H2,1-5H3,(H,23,25)
InChIKeySXZGHGRMWVKECO-UHFFFAOYSA-N
XLogP4.08
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide?
The IUPAC name of N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide (CID 24747027) is N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide is Cc1nc2c(cc1NC(=O)C(C)(C)C)nc(C)n2Cc1ccccc1.
What is the InChIKey of N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide?
The InChIKey is SXZGHGRMWVKECO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c1-13-16(23-19(25)20(3,4)5)11-17-18(21-13)24(14(2)22-17)12-15-9-7-6-8-10-15/h6-11H,12H2,1-5H3,(H,23,25).
What are the key properties of N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide?
N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide has a molecular weight of 336.44 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzyl-2,5-dimethylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide is sourced from PubChem (CID 24747027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).