2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide

C18H20N6O2 — CID 91193302

IUPAC2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide
SMILESCC1C=NCN1CCCNC(=O)c1ccnc2nc(-c3ccoc3)[nH]c12
InChIInChI=1S/C18H20N6O2/c1-12-9-19-11-24(12)7-2-5-21-18(25)14-3-6-20-17-15(14)22-16(23-17)13-4-8-26-10-13/h3-4,6,8-10,12H,2,5,7,11H2,1H3,(H,21,25)(H,20,22,23)
InChIKeyBKALYDWZUOGYOF-UHFFFAOYSA-N
MW352.40 g/mol
LogP2.07
Rot. Bonds6

About 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide

2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide (PubChem CID 91193302) has the molecular formula C18H20N6O2 and a molecular weight of 352.40 g/mol. Its IUPAC name is 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide.

Molecular Properties

Compound Name2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide
PubChem CID91193302
Molecular FormulaC18H20N6O2
Molecular Weight352.40 g/mol
Exact Mass352.16
IUPAC Name2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide
SMILESCC1C=NCN1CCCNC(=O)c1ccnc2nc(-c3ccoc3)[nH]c12
InChIInChI=1S/C18H20N6O2/c1-12-9-19-11-24(12)7-2-5-21-18(25)14-3-6-20-17-15(14)22-16(23-17)13-4-8-26-10-13/h3-4,6,8-10,12H,2,5,7,11H2,1H3,(H,21,25)(H,20,22,23)
InChIKeyBKALYDWZUOGYOF-UHFFFAOYSA-N
XLogP2.07
TPSA99.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.40
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-(furan-3-yl)-N-[3-(4-methyl-1,2-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 68935746
N-[3-(2,4-dihydroimidazol-3-yl)propyl]-2-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 90687573
2-(4-chlorophenyl)-N-(3-imidazol-1-ylpropyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 24786115
N-(3-methoxypropyl)-2-[4-(morpholin-4-ylmethyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide;hydrochloride
CID 68721807
2-cyclopropyl-N-[3-(4-methyl-1,2-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 68938854
N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 143508177
methyl 2-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylate
CID 25179835
N-[2-[4-[[2-(dimethylamino)acetyl]amino]phenyl]ethyl]-2-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 24784327
N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 70810297
2-[4-[2-(dimethylamino)ethylamino]phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 69258409
2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 140538831
N-[(2R,3R)-2-(2-ethylpyrazol-3-yl)oxolan-3-yl]-2-methyl-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 136584076

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The IUPAC name of 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide (CID 91193302) is 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide.
What is the SMILES notation for 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The canonical SMILES for 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide is CC1C=NCN1CCCNC(=O)c1ccnc2nc(-c3ccoc3)[nH]c12.
What is the InChIKey of 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The InChIKey is BKALYDWZUOGYOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O2/c1-12-9-19-11-24(12)7-2-5-21-18(25)14-3-6-20-17-15(14)22-16(23-17)13-4-8-26-10-13/h3-4,6,8-10,12H,2,5,7,11H2,1H3,(H,21,25)(H,20,22,23).
What are the key properties of 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide?
2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide has a molecular weight of 352.40 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-N-[3-(4-methyl-2,4-dihydroimidazol-3-yl)propyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide is sourced from PubChem (CID 91193302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).