N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine

C11H14N4O — CID 63590047

IUPACN-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine
SMILESCOc1cccc(NCCn2ccnc2)n1
InChIInChI=1S/C11H14N4O/c1-16-11-4-2-3-10(14-11)13-6-8-15-7-5-12-9-15/h2-5,7,9H,6,8H2,1H3,(H,13,14)
InChIKeyFTMZTFIBZMOVNM-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.40
Rot. Bonds5

About N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine

N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine (PubChem CID 63590047) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine.

Molecular Properties

Compound NameN-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine
PubChem CID63590047
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC NameN-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine
SMILESCOc1cccc(NCCn2ccnc2)n1
InChIInChI=1S/C11H14N4O/c1-16-11-4-2-3-10(14-11)13-6-8-15-7-5-12-9-15/h2-5,7,9H,6,8H2,1H3,(H,13,14)
InChIKeyFTMZTFIBZMOVNM-UHFFFAOYSA-N
XLogP1.40
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine?
The IUPAC name of N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine (CID 63590047) is N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine.
What is the SMILES notation for N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine?
The canonical SMILES for N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine is COc1cccc(NCCn2ccnc2)n1.
What is the InChIKey of N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine?
The InChIKey is FTMZTFIBZMOVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-16-11-4-2-3-10(14-11)13-6-8-15-7-5-12-9-15/h2-5,7,9H,6,8H2,1H3,(H,13,14).
What are the key properties of N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine?
N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine has a molecular weight of 218.26 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine is sourced from PubChem (CID 63590047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).