1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine

C12H16N4 — CID 107504565

IUPAC1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine
SMILESCNCc1cnc(-c2cc(C)nc(C)c2)[nH]1
InChIInChI=1S/C12H16N4/c1-8-4-10(5-9(2)15-8)12-14-7-11(16-12)6-13-3/h4-5,7,13H,6H2,1-3H3,(H,14,16)
InChIKeyOMFVQRZPUWAXDO-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.81
Rot. Bonds3

About 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine

1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine (PubChem CID 107504565) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine
PubChem CID107504565
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine
SMILESCNCc1cnc(-c2cc(C)nc(C)c2)[nH]1
InChIInChI=1S/C12H16N4/c1-8-4-10(5-9(2)15-8)12-14-7-11(16-12)6-13-3/h4-5,7,13H,6H2,1-3H3,(H,14,16)
InChIKeyOMFVQRZPUWAXDO-UHFFFAOYSA-N
XLogP1.81
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dimethyl-4-(5-methyl-1H-imidazol-2-yl)pyridine
CID 107504185
1-[2-(3-fluorophenyl)-1H-imidazol-5-yl]-N-methylmethanamine
CID 63108684
N-methyl-1-[2-(4-propan-2-ylphenyl)-1H-imidazol-5-yl]methanamine
CID 55178244
N-methyl-1-[2-(4-methylsulfanylphenyl)-1H-imidazol-5-yl]methanamine
CID 106849874
1-[2-(5-fluoro-2-methylphenyl)-1H-imidazol-5-yl]-N-methylmethanamine
CID 63108953
N-methyl-1-(2-phenyl-1H-imidazol-5-yl)methanamine;2-phenyl-1H-imidazole-5-carbaldehyde;dihydrochloride
CID 158284704
N-[[2-(3,5-dichlorophenyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
CID 107918177
[2-(3,5-dimethylphenyl)-1H-imidazol-5-yl]methanamine
CID 82506278
N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine
CID 63108982
1-[2-(fluoromethyl)-1H-imidazol-5-yl]-N-methylmethanamine
CID 84762762
1-[2-[4-bromo-2-(trifluoromethyl)phenyl]-1H-imidazol-5-yl]-N-methylmethanamine
CID 55178437
1-[2-(2-methoxypropan-2-yl)-1H-imidazol-5-yl]-N-methylmethanamine
CID 79198080

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine (CID 107504565) is 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine is CNCc1cnc(-c2cc(C)nc(C)c2)[nH]1.
What is the InChIKey of 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine?
The InChIKey is OMFVQRZPUWAXDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-8-4-10(5-9(2)15-8)12-14-7-11(16-12)6-13-3/h4-5,7,13H,6H2,1-3H3,(H,14,16).
What are the key properties of 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine?
1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine has a molecular weight of 216.29 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,6-dimethyl-4-pyridinyl)-1H-imidazol-5-yl]-N-methylmethanamine is sourced from PubChem (CID 107504565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).