N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide

C20H16N6O2 — CID 44603104

IUPACN-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc3nc(Nc4ccccn4)ncc3c2)ccn1
InChIInChI=1S/C20H16N6O2/c1-21-19(27)17-11-15(7-9-22-17)28-14-5-6-16-13(10-14)12-24-20(25-16)26-18-4-2-3-8-23-18/h2-12H,1H3,(H,21,27)(H,23,24,25,26)
InChIKeyNEIYGRYKFHXLIN-UHFFFAOYSA-N
MW372.39 g/mol
LogP3.32
Rot. Bonds5

About N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide

N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide (PubChem CID 44603104) has the molecular formula C20H16N6O2 and a molecular weight of 372.39 g/mol. Its IUPAC name is N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide
PubChem CID44603104
Molecular FormulaC20H16N6O2
Molecular Weight372.39 g/mol
Exact Mass372.13
IUPAC NameN-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc3nc(Nc4ccccn4)ncc3c2)ccn1
InChIInChI=1S/C20H16N6O2/c1-21-19(27)17-11-15(7-9-22-17)28-14-5-6-16-13(10-14)12-24-20(25-16)26-18-4-2-3-8-23-18/h2-12H,1H3,(H,21,27)(H,23,24,25,26)
InChIKeyNEIYGRYKFHXLIN-UHFFFAOYSA-N
XLogP3.32
TPSA101.92 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.39
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

4-(2-anilinoquinazolin-6-yl)oxy-N-methylpyridine-2-carboxamide
CID 57399505
N-methyl-4-[2-(2-methyl-5-phenylanilino)quinazolin-6-yl]oxypyridine-2-carboxamide
CID 59254883
4-[2-[(6-chloro-3-pyridinyl)amino]quinazolin-6-yl]oxy-N-methylpyridine-2-carboxamide
CID 59254896
4-[2-(3-fluoro-2-methylanilino)quinazolin-6-yl]oxy-N-methylpyridine-2-carboxamide
CID 59254892
ethane;N-methyl-4-[2-(3-phenylmethoxyanilino)quinazolin-6-yl]oxypyridine-2-carboxamide
CID 143038075
4-[2-(4-bromo-3-fluoroanilino)quinazolin-6-yl]oxy-N-methylpyridine-2-carboxamide
CID 59254857
4-[2-(cyclopentylamino)quinazolin-6-yl]oxy-N-methylpyridine-2-carboxamide
CID 42642424
N-methyl-4-[2-[2-(4-methylpiperazin-1-yl)anilino]quinazolin-6-yl]oxypyridine-2-carboxamide;N-methyl-4-(2-methylsulfonylquinazolin-6-yl)oxypyridine-2-carboxamide
CID 157203649
4-[2-(2-bicyclo[2.2.1]heptanylamino)quinazolin-6-yl]oxy-N-methylpyridine-2-carboxamide
CID 59254869
4-(2-aminoquinolin-6-yl)oxy-N-methylpyridine-2-carboxamide
CID 71019360
4-[2-(3,4-difluoroanilino)quinolin-6-yl]oxy-N-methylpyridine-2-carboxamide
CID 155810675
4-[2-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]quinolin-6-yl]oxy-N-methylpyridine-2-carboxamide
CID 42641176

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide?
The IUPAC name of N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide (CID 44603104) is N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide?
The canonical SMILES for N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide is CNC(=O)c1cc(Oc2ccc3nc(Nc4ccccn4)ncc3c2)ccn1.
What is the InChIKey of N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide?
The InChIKey is NEIYGRYKFHXLIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6O2/c1-21-19(27)17-11-15(7-9-22-17)28-14-5-6-16-13(10-14)12-24-20(25-16)26-18-4-2-3-8-23-18/h2-12H,1H3,(H,21,27)(H,23,24,25,26).
What are the key properties of N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide?
N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide has a molecular weight of 372.39 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[2-(pyridin-2-ylamino)quinazolin-6-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 44603104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).