N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine

C10H12N4 — CID 64532478

IUPACN-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine
SMILESCc1ccc(NCc2ncc[nH]2)nc1
InChIInChI=1S/C10H12N4/c1-8-2-3-9(13-6-8)14-7-10-11-4-5-12-10/h2-6H,7H2,1H3,(H,11,12)(H,13,14)
InChIKeyVKNRNDZYOYIHDZ-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.73
Rot. Bonds3

About N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine

N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine (PubChem CID 64532478) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine
PubChem CID64532478
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC NameN-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine
SMILESCc1ccc(NCc2ncc[nH]2)nc1
InChIInChI=1S/C10H12N4/c1-8-2-3-9(13-6-8)14-7-10-11-4-5-12-10/h2-6H,7H2,1H3,(H,11,12)(H,13,14)
InChIKeyVKNRNDZYOYIHDZ-UHFFFAOYSA-N
XLogP1.73
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine?
The IUPAC name of N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine (CID 64532478) is N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine.
What is the SMILES notation for N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine?
The canonical SMILES for N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine is Cc1ccc(NCc2ncc[nH]2)nc1.
What is the InChIKey of N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine?
The InChIKey is VKNRNDZYOYIHDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-8-2-3-9(13-6-8)14-7-10-11-4-5-12-10/h2-6H,7H2,1H3,(H,11,12)(H,13,14).
What are the key properties of N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine?
N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine has a molecular weight of 188.23 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-ylmethyl)-5-methylpyridin-2-amine is sourced from PubChem (CID 64532478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).