2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole

C17H18N2O — CID 59857344

IUPAC2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole
SMILESCc1nc2ccc(C(C)OCc3ccccc3)cc2[nH]1
InChIInChI=1S/C17H18N2O/c1-12(20-11-14-6-4-3-5-7-14)15-8-9-16-17(10-15)19-13(2)18-16/h3-10,12H,11H2,1-2H3,(H,18,19)
InChIKeyRCMFVSRARMJDHY-UHFFFAOYSA-N
MW266.34 g/mol
LogP4.15
Rot. Bonds4

About 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole

2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole (PubChem CID 59857344) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole.

Molecular Properties

Compound Name2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole
PubChem CID59857344
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole
SMILESCc1nc2ccc(C(C)OCc3ccccc3)cc2[nH]1
InChIInChI=1S/C17H18N2O/c1-12(20-11-14-6-4-3-5-7-14)15-8-9-16-17(10-15)19-13(2)18-16/h3-10,12H,11H2,1-2H3,(H,18,19)
InChIKeyRCMFVSRARMJDHY-UHFFFAOYSA-N
XLogP4.15
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-6-propan-2-yl-1H-benzimidazole
CID 21069154
1-methyl-4-(1-phenylmethoxyethyl)benzene
CID 135034119
2-methyl-1-(2-methyl-3H-benzimidazol-5-yl)propan-1-amine
CID 82491804
benzyl 2,2-difluoro-2-[(2-methyl-3H-benzimidazol-5-yl)oxy]acetate
CID 170102023
1-(2-methyl-3H-benzimidazol-5-yl)propane-1,2,3-triol
CID 170818053
2-(2-methyl-3H-benzimidazol-5-yl)-2-pyridin-2-ylacetic acid
CID 116824710
2-methyl-6-(4-phenylphenyl)-1H-benzimidazole
CID 175938016
N-benzyl-2-methyl-N-propan-2-yl-3H-benzimidazole-5-sulfonamide
CID 110760148
1-methoxy-N-methyl-1-(2-methyl-3H-benzimidazol-5-yl)methanamine
CID 116961533
hydrazinyl-(2-methyl-3H-benzimidazol-5-yl)methanamine
CID 116947494
methylamino-(2-methyl-3H-benzimidazol-5-yl)methanol
CID 116954709
N-[2-(2-tert-butylphenoxy)-3-pyridinyl]-6-[1-[(4-phenoxyphenyl)methoxy]ethyl]-1H-benzimidazol-2-amine
CID 69291692

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole?
The IUPAC name of 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole (CID 59857344) is 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole.
What is the SMILES notation for 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole?
The canonical SMILES for 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole is Cc1nc2ccc(C(C)OCc3ccccc3)cc2[nH]1.
What is the InChIKey of 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole?
The InChIKey is RCMFVSRARMJDHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-12(20-11-14-6-4-3-5-7-14)15-8-9-16-17(10-15)19-13(2)18-16/h3-10,12H,11H2,1-2H3,(H,18,19).
What are the key properties of 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole?
2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole has a molecular weight of 266.34 g/mol, XLogP of 4.15, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(1-phenylmethoxyethyl)-1H-benzimidazole is sourced from PubChem (CID 59857344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).