N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen

C18H22N4O2 — CID 164540019

IUPACN-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen
SMILESCNC(=O)c1cc(Oc2ccc3c(c2)nc(C(C)C)n3C)ccn1.[H][H]
InChIInChI=1S/C18H20N4O2.H2/c1-11(2)17-21-14-9-12(5-6-16(14)22(17)4)24-13-7-8-20-15(10-13)18(23)19-3;/h5-11H,1-4H3,(H,19,23);1H
InChIKeyLZRVGMIOPLPHKE-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.49
Rot. Bonds4

About N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen

N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen (PubChem CID 164540019) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen.

Molecular Properties

Compound NameN-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen
PubChem CID164540019
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC NameN-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen
SMILESCNC(=O)c1cc(Oc2ccc3c(c2)nc(C(C)C)n3C)ccn1.[H][H]
InChIInChI=1S/C18H20N4O2.H2/c1-11(2)17-21-14-9-12(5-6-16(14)22(17)4)24-13-7-8-20-15(10-13)18(23)19-3;/h5-11H,1-4H3,(H,19,23);1H
InChIKeyLZRVGMIOPLPHKE-UHFFFAOYSA-N
XLogP3.49
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-4-[1-methyl-2-[4-(methylamino)anilino]benzimidazol-5-yl]oxypyridine-2-carboxamide
CID 22041311
N-methyl-4-[1-methyl-2-[4-(propan-2-ylcarbamoyl)anilino]benzimidazol-5-yl]oxypyridine-2-carboxamide
CID 22040471
4-[2-(2,4-dibromoanilino)-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-2-carboxamide
CID 22041058
4-[2-[4-(dimethylamino)anilino]-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-2-carboxamide
CID 21037270
N-methyl-4-[1-methyl-2-[4-(trifluoromethyl)anilino]benzimidazol-5-yl]oxypyridine-2-carboxamide
CID 22041171
4-[2-(cycloheptylmethylamino)-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-2-carboxamide
CID 22041264
N-methyl-4-[1-methyl-2-[[4-(trifluoromethoxy)phenyl]methyl]benzimidazol-5-yl]oxypyridine-2-carboxamide
CID 22040988
N-methyl-4-[1-methyl-2-[4-(4-nitrophenoxy)anilino]benzimidazol-5-yl]oxypyridine-2-carboxamide
CID 22040422
N-methyl-4-[1-methyl-2-(2-morpholin-4-ylethylamino)benzimidazol-5-yl]oxypyridine-2-carboxamide
CID 22041180
4-[2-(4-cyano-2-hydroxyanilino)-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-2-carboxamide
CID 71010320
N-methyl-4-[1-methyl-2-[3-(trifluoromethylsulfanyl)anilino]benzimidazol-5-yl]oxypyridine-2-carboxamide;molecular hydrogen
CID 158740821
4-[2-(3-imidazol-1-ylpropylamino)-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-2-carboxamide
CID 22040660

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen?
The IUPAC name of N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen (CID 164540019) is N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen.
What is the SMILES notation for N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen?
The canonical SMILES for N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen is CNC(=O)c1cc(Oc2ccc3c(c2)nc(C(C)C)n3C)ccn1.[H][H].
What is the InChIKey of N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen?
The InChIKey is LZRVGMIOPLPHKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2.H2/c1-11(2)17-21-14-9-12(5-6-16(14)22(17)4)24-13-7-8-20-15(10-13)18(23)19-3;/h5-11H,1-4H3,(H,19,23);1H.
What are the key properties of N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen?
N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen has a molecular weight of 326.40 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(1-methyl-2-propan-2-ylbenzimidazol-5-yl)oxypyridine-2-carboxamide;molecular hydrogen is sourced from PubChem (CID 164540019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).