N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine

C22H20N4O — CID 142682626

IUPACN-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine
SMILESCn1c(Nc2ccc3c(c2)CCC3)nc2cc(Oc3ccncc3)ccc21
InChIInChI=1S/C22H20N4O/c1-26-21-8-7-19(27-18-9-11-23-12-10-18)14-20(21)25-22(26)24-17-6-5-15-3-2-4-16(15)13-17/h5-14H,2-4H2,1H3,(H,24,25)
InChIKeyQYNBXTOCGATYDU-UHFFFAOYSA-N
MW356.43 g/mol
LogP4.99
Rot. Bonds4

About N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine

N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine (PubChem CID 142682626) has the molecular formula C22H20N4O and a molecular weight of 356.43 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine
PubChem CID142682626
Molecular FormulaC22H20N4O
Molecular Weight356.43 g/mol
Exact Mass356.16
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine
SMILESCn1c(Nc2ccc3c(c2)CCC3)nc2cc(Oc3ccncc3)ccc21
InChIInChI=1S/C22H20N4O/c1-26-21-8-7-19(27-18-9-11-23-12-10-18)14-20(21)25-22(26)24-17-6-5-15-3-2-4-16(15)13-17/h5-14H,2-4H2,1H3,(H,24,25)
InChIKeyQYNBXTOCGATYDU-UHFFFAOYSA-N
XLogP4.99
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(2,3-dihydro-1H-inden-5-ylamino)-1-methylbenzimidazol-5-yl]oxypyridine-2-carbaldehyde
CID 90769463
4-(2,3-dihydro-1H-inden-5-yloxy)pyridine
CID 57051000
4-[1-methyl-2-(4-methylanilino)benzimidazol-5-yl]oxypyridine-2-carbonitrile
CID 70839088
N-methyl-4-[1-methyl-2-[(3-oxo-1,2-dihydroisoindol-5-yl)amino]benzimidazol-5-yl]oxypyridine-2-carboxamide
CID 22041150
4-[1-methyl-2-[4-(trifluoromethyl)anilino]benzimidazol-5-yl]oxypyridine-2-carbaldehyde
CID 91351416
N-[4-[1-methyl-2-[4-(trifluoromethyl)anilino]benzimidazol-5-yl]oxy-2-pyridinyl]-2-pyrrolidin-1-ylacetamide
CID 59790124
N-(3,4-dimethylphenyl)-1-methyl-5-[[2-(nitrosomethyl)-4-pyridinyl]oxy]benzimidazol-2-amine
CID 91112791
N-methyl-4-[1-methyl-2-[4-(methylamino)anilino]benzimidazol-5-yl]oxypyridine-2-carboxamide
CID 22041311
CID 89129994
CID 89129994
N-(1-methylpiperidin-4-yl)-4-[1-methyl-2-(3-pyridin-4-ylanilino)benzimidazol-5-yl]oxypyridine-2-carboxamide;molecular hydrogen
CID 161392104
N-[4-[2-(4-bromoanilino)-1-methylbenzimidazol-5-yl]oxy-2-pyridinyl]-1-methylpiperidin-1-ium-1-carboxamide
CID 22040515
N-(4-bromophenyl)-5-[[2-[(dimethylamino)methyl]-4-pyridinyl]oxy]-1-methylbenzimidazol-2-amine
CID 21037353

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine (CID 142682626) is N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine is Cn1c(Nc2ccc3c(c2)CCC3)nc2cc(Oc3ccncc3)ccc21.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine?
The InChIKey is QYNBXTOCGATYDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O/c1-26-21-8-7-19(27-18-9-11-23-12-10-18)14-20(21)25-22(26)24-17-6-5-15-3-2-4-16(15)13-17/h5-14H,2-4H2,1H3,(H,24,25).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine?
N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine has a molecular weight of 356.43 g/mol, XLogP of 4.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-5-pyridin-4-yloxybenzimidazol-2-amine is sourced from PubChem (CID 142682626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).