N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide

C18H22N4OS — CID 175645068

IUPACN-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
SMILESCC(C)Cn1cnc2cc(C(=O)N(C)C(C)c3cccs3)cnc21
InChIInChI=1S/C18H22N4OS/c1-12(2)10-22-11-20-15-8-14(9-19-17(15)22)18(23)21(4)13(3)16-6-5-7-24-16/h5-9,11-13H,10H2,1-4H3
InChIKeySFJONJASLRKZAN-UHFFFAOYSA-N
MW342.47 g/mol
LogP3.98
Rot. Bonds5

About N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide

N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 175645068) has the molecular formula C18H22N4OS and a molecular weight of 342.47 g/mol. Its IUPAC name is N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
PubChem CID175645068
Molecular FormulaC18H22N4OS
Molecular Weight342.47 g/mol
Exact Mass342.15
IUPAC NameN-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
SMILESCC(C)Cn1cnc2cc(C(=O)N(C)C(C)c3cccs3)cnc21
InChIInChI=1S/C18H22N4OS/c1-12(2)10-22-11-20-15-8-14(9-19-17(15)22)18(23)21(4)13(3)16-6-5-7-24-16/h5-9,11-13H,10H2,1-4H3
InChIKeySFJONJASLRKZAN-UHFFFAOYSA-N
XLogP3.98
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.47
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 175642076
N-methyl-N-[(1S)-1-thiophen-2-ylethyl]-2H-benzotriazole-5-carboxamide
CID 31620123
3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 175642857
N-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-3-(2-phenylethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 176506197
N-methyl-2-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 62180310
4-amino-N-methyl-N-(1-thiophen-2-ylethyl)pyridine-2-carboxamide
CID 55041564
N-methyl-4-sulfanyl-N-(1-thiophen-2-ylethyl)benzamide
CID 107025969
N-methyl-7-phenyl-N-(1-thiophen-2-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55789049
3-(2-methylpropyl)-N-[(5-oxopyrrolidin-3-yl)methyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 176507089
3-(2-methylpropyl)-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)imidazo[4,5-b]pyridine-6-carboxamide
CID 176504414
[(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone
CID 176503964
3-bromo-4-chloro-N-methyl-N-(1-thiophen-2-ylethyl)benzamide
CID 113329880

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide (CID 175645068) is N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide is CC(C)Cn1cnc2cc(C(=O)N(C)C(C)c3cccs3)cnc21.
What is the InChIKey of N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is SFJONJASLRKZAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4OS/c1-12(2)10-22-11-20-15-8-14(9-19-17(15)22)18(23)21(4)13(3)16-6-5-7-24-16/h5-9,11-13H,10H2,1-4H3.
What are the key properties of N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide?
N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 342.47 g/mol, XLogP of 3.98, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 175645068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).