N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide

C21H17FN4O3 — CID 55716212

IUPACN-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1occc1C(=O)Nc1cc(NC(=O)c2cn3c(C)cccc3n2)ccc1F
InChIInChI=1S/C21H17FN4O3/c1-12-4-3-5-19-24-18(11-26(12)19)21(28)23-14-6-7-16(22)17(10-14)25-20(27)15-8-9-29-13(15)2/h3-11H,1-2H3,(H,23,28)(H,25,27)
InChIKeyBVLNUNYWGHEUMJ-UHFFFAOYSA-N
MW392.39 g/mol
LogP4.19
Rot. Bonds4

About N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide

N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 55716212) has the molecular formula C21H17FN4O3 and a molecular weight of 392.39 g/mol. Its IUPAC name is N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID55716212
Molecular FormulaC21H17FN4O3
Molecular Weight392.39 g/mol
Exact Mass392.13
IUPAC NameN-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1occc1C(=O)Nc1cc(NC(=O)c2cn3c(C)cccc3n2)ccc1F
InChIInChI=1S/C21H17FN4O3/c1-12-4-3-5-19-24-18(11-26(12)19)21(28)23-14-6-7-16(22)17(10-14)25-20(27)15-8-9-29-13(15)2/h3-11H,1-2H3,(H,23,28)(H,25,27)
InChIKeyBVLNUNYWGHEUMJ-UHFFFAOYSA-N
XLogP4.19
TPSA88.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.39
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-acetamidophenyl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 26114454
N-[4-(furan-2-carbonylamino)-2-(trifluoromethyl)phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 55501032
5-methyl-N-(3-methylsulfanylphenyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 26086848
N-(4-bromo-3-methylphenyl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 26363542
N-[3-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 75405070
N-[5-[(4-cyanobenzoyl)amino]-2-fluorophenyl]-2-methylfuran-3-carboxamide
CID 46466434
N-[3-(hydroxymethyl)phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 60630109
N-[5-[2-(3-chlorophenoxy)propanoylamino]-2-fluorophenyl]-2-methylfuran-3-carboxamide
CID 55707775
N-[5-[[2-(2,4-dichlorophenyl)acetyl]amino]-2-fluorophenyl]-2-methylfuran-3-carboxamide
CID 55707274
N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-1-(3-methoxyphenyl)-5-methyltriazole-4-carboxamide
CID 55723718
N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-3-phenyl-2,1-benzoxazole-5-carboxamide
CID 55707486
N-(3-carbamothioyl-4-fluorophenyl)-2-methylfuran-3-carboxamide
CID 62318069

Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 55716212) is N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide is Cc1occc1C(=O)Nc1cc(NC(=O)c2cn3c(C)cccc3n2)ccc1F.
What is the InChIKey of N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is BVLNUNYWGHEUMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O3/c1-12-4-3-5-19-24-18(11-26(12)19)21(28)23-14-6-7-16(22)17(10-14)25-20(27)15-8-9-29-13(15)2/h3-11H,1-2H3,(H,23,28)(H,25,27).
What are the key properties of N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide?
N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 392.39 g/mol, XLogP of 4.19, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-3-[(2-methylfuran-3-carbonyl)amino]phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 55716212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).