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

C13H18N4 — CID 106562046

IUPAC1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine
SMILESCCn1cc(C)nc1NC(C)c1ccncc1
InChIInChI=1S/C13H18N4/c1-4-17-9-10(2)15-13(17)16-11(3)12-5-7-14-8-6-12/h5-9,11H,4H2,1-3H3,(H,15,16)
InChIKeyJILPSPANOWHFSJ-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.78
Rot. Bonds4

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

1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine (PubChem CID 106562046) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine.

Molecular Properties

Compound Name1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine
PubChem CID106562046
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine
SMILESCCn1cc(C)nc1NC(C)c1ccncc1
InChIInChI=1S/C13H18N4/c1-4-17-9-10(2)15-13(17)16-11(3)12-5-7-14-8-6-12/h5-9,11H,4H2,1-3H3,(H,15,16)
InChIKeyJILPSPANOWHFSJ-UHFFFAOYSA-N
XLogP2.78
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine?
The IUPAC name of 1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine (CID 106562046) is 1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine.
What is the SMILES notation for 1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine?
The canonical SMILES for 1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine is CCn1cc(C)nc1NC(C)c1ccncc1.
What is the InChIKey of 1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine?
The InChIKey is JILPSPANOWHFSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-4-17-9-10(2)15-13(17)16-11(3)12-5-7-14-8-6-12/h5-9,11H,4H2,1-3H3,(H,15,16).
What are the key properties of 1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine?
1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine has a molecular weight of 230.31 g/mol, XLogP of 2.78, 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-(1-pyridin-4-ylethyl)imidazol-2-amine is sourced from PubChem (CID 106562046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).