(1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine

C10H12N4 — CID 83697482

IUPAC(1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine
SMILESCn1c(-c2cccnc2)cnc1CN
InChIInChI=1S/C10H12N4/c1-14-9(7-13-10(14)5-11)8-3-2-4-12-6-8/h2-4,6-7H,5,11H2,1H3
InChIKeyVJLAFVDBKXRSHS-UHFFFAOYSA-N
MW188.23 g/mol
LogP0.94
Rot. Bonds2

About (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine

(1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine (PubChem CID 83697482) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine.

Molecular Properties

Compound Name(1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine
PubChem CID83697482
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name(1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine
SMILESCn1c(-c2cccnc2)cnc1CN
InChIInChI=1S/C10H12N4/c1-14-9(7-13-10(14)5-11)8-3-2-4-12-6-8/h2-4,6-7H,5,11H2,1H3
InChIKeyVJLAFVDBKXRSHS-UHFFFAOYSA-N
XLogP0.94
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,3-dimethylimidazol-4-yl)pyridine
CID 44549702
1-(1-methyl-5-phenylimidazol-2-yl)propan-2-amine
CID 83849134
3-(2-methyl-1H-diazet-3-yl)pyridine
CID 144904060
3-(1-methylpyrrol-2-yl)pyridine
CID 10249
3-(1-methyl(213C)pyrrol-2-yl)(2,3,4,5,6-13C5)pyridine
CID 169444700
3-(2-bromo-3-propan-2-ylimidazol-4-yl)pyridine
CID 117260068
(5-chloro-1-methylimidazol-2-yl)methanamine;dihydrochloride
CID 119057052
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
2-(5-methyl-2-pyridin-3-ylimidazol-1-yl)ethanamine;dihydrochloride
CID 146064771
3-(5-ethyl-4-methyl-1,2,4-triazol-3-yl)pyridine
CID 18726700
(2-pyridin-3-yl-3-pyridinyl)methanamine
CID 19005903
1-methyl-5-phenyl-N-(pyridin-3-ylmethyl)imidazol-2-amine
CID 51361863

Frequently Asked Questions

What is the IUPAC name of (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine?
The IUPAC name of (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine (CID 83697482) is (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine.
What is the SMILES notation for (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine?
The canonical SMILES for (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine is Cn1c(-c2cccnc2)cnc1CN.
What is the InChIKey of (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine?
The InChIKey is VJLAFVDBKXRSHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-14-9(7-13-10(14)5-11)8-3-2-4-12-6-8/h2-4,6-7H,5,11H2,1H3.
What are the key properties of (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine?
(1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine has a molecular weight of 188.23 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-5-pyridin-3-ylimidazol-2-yl)methanamine is sourced from PubChem (CID 83697482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).