2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine

C20H19N5O — CID 118101571

IUPAC2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine
SMILESCOc1ccc(Nc2cc(N)cc(-n3c(C)nc4ccccc43)n2)cc1
InChIInChI=1S/C20H19N5O/c1-13-22-17-5-3-4-6-18(17)25(13)20-12-14(21)11-19(24-20)23-15-7-9-16(26-2)10-8-15/h3-12H,1-2H3,(H3,21,23,24)
InChIKeyZYRVGEUPQCWBKU-UHFFFAOYSA-N
MW345.41 g/mol
LogP4.06
Rot. Bonds4

About 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine

2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine (PubChem CID 118101571) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine.

Molecular Properties

Compound Name2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine
PubChem CID118101571
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC Name2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine
SMILESCOc1ccc(Nc2cc(N)cc(-n3c(C)nc4ccccc43)n2)cc1
InChIInChI=1S/C20H19N5O/c1-13-22-17-5-3-4-6-18(17)25(13)20-12-14(21)11-19(24-20)23-15-7-9-16(26-2)10-8-15/h3-12H,1-2H3,(H3,21,23,24)
InChIKeyZYRVGEUPQCWBKU-UHFFFAOYSA-N
XLogP4.06
TPSA77.99 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine
CID 118101514
4-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,3-diamine
CID 118094724
2-N-(4-chlorophenyl)-6-(5,6-difluoro-2-methylbenzimidazol-1-yl)pyridine-2,4-diamine
CID 118101521
N-(4-chlorophenyl)-4-(2,5-dimethylpyrrol-1-yl)-6-(2-methylbenzimidazol-1-yl)pyridin-2-amine
CID 118095021
N-[4-(difluoromethoxy)phenyl]-6-(2-methylbenzimidazol-1-yl)-4-oxidopyrazin-4-ium-2-amine
CID 118095026
5-fluoro-4-N-(3-methoxyphenyl)-2-(2-methylbenzimidazol-1-yl)pyrimidine-4,6-diamine
CID 90178193
sodium;acetic acid;benzene-1,2-diamine;2-N-(6-chloro-4-methyl-2-pyridinyl)benzene-1,2-diamine;1-(6-chloro-4-methyl-2-pyridinyl)-2-methylbenzimidazole;2,6-dichloro-4-methylpyridine;4-methoxyaniline;N-(4-methoxyphenyl)-4-methyl-6-(2-methylbenzimidazol-1-yl)pyridin-2-amine;2-methylbutan-2-olate;1,1,1-trimethoxyethane
CID 158551498
5-(4-methoxyphenyl)-2-(2-methylbenzimidazol-1-yl)pyrimidine-4,6-diamine
CID 151304160
6-(6-methoxy-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
CID 118095066
2-(6-amino-2-methylbenzimidazol-1-yl)-5-fluoro-4-N-(4-methoxyphenyl)pyrimidine-4,6-diamine
CID 90182221
N-[4-(difluoromethyl)-3-fluorophenyl]-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine
CID 118101485
N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine
CID 158012117

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine?
The IUPAC name of 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine (CID 118101571) is 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine.
What is the SMILES notation for 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine?
The canonical SMILES for 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine is COc1ccc(Nc2cc(N)cc(-n3c(C)nc4ccccc43)n2)cc1.
What is the InChIKey of 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine?
The InChIKey is ZYRVGEUPQCWBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O/c1-13-22-17-5-3-4-6-18(17)25(13)20-12-14(21)11-19(24-20)23-15-7-9-16(26-2)10-8-15/h3-12H,1-2H3,(H3,21,23,24).
What are the key properties of 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine?
2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine has a molecular weight of 345.41 g/mol, XLogP of 4.06, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-methoxyphenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine is sourced from PubChem (CID 118101571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).