1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine

C12H16N4 — CID 106560389

IUPAC1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine
SMILESCCn1cc(C)nc1NCc1ccncc1
InChIInChI=1S/C12H16N4/c1-3-16-9-10(2)15-12(16)14-8-11-4-6-13-7-5-11/h4-7,9H,3,8H2,1-2H3,(H,14,15)
InChIKeyGQYCLAYXPWATPX-UHFFFAOYSA-N
MW216.29 g/mol
LogP2.22
Rot. Bonds4

About 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine

1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine (PubChem CID 106560389) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound Name1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine
PubChem CID106560389
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine
SMILESCCn1cc(C)nc1NCc1ccncc1
InChIInChI=1S/C12H16N4/c1-3-16-9-10(2)15-12(16)14-8-11-4-6-13-7-5-11/h4-7,9H,3,8H2,1-2H3,(H,14,15)
InChIKeyGQYCLAYXPWATPX-UHFFFAOYSA-N
XLogP2.22
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine?
The IUPAC name of 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine (CID 106560389) is 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine.
What is the SMILES notation for 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine?
The canonical SMILES for 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine is CCn1cc(C)nc1NCc1ccncc1.
What is the InChIKey of 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine?
The InChIKey is GQYCLAYXPWATPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-3-16-9-10(2)15-12(16)14-8-11-4-6-13-7-5-11/h4-7,9H,3,8H2,1-2H3,(H,14,15).
What are the key properties of 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine?
1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine has a molecular weight of 216.29 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106560389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).