3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine

C11H14N4 — CID 62465807

IUPAC3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine
SMILESCCc1nccn1Cc1cccnc1N
InChIInChI=1S/C11H14N4/c1-2-10-13-6-7-15(10)8-9-4-3-5-14-11(9)12/h3-7H,2,8H2,1H3,(H2,12,14)
InChIKeyOHCFFAUFOPKUQZ-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.47
Rot. Bonds3

About 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine

3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine (PubChem CID 62465807) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine
PubChem CID62465807
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine
SMILESCCc1nccn1Cc1cccnc1N
InChIInChI=1S/C11H14N4/c1-2-10-13-6-7-15(10)8-9-4-3-5-14-11(9)12/h3-7H,2,8H2,1H3,(H2,12,14)
InChIKeyOHCFFAUFOPKUQZ-UHFFFAOYSA-N
XLogP1.47
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine (CID 62465807) is 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine is CCc1nccn1Cc1cccnc1N.
What is the InChIKey of 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine?
The InChIKey is OHCFFAUFOPKUQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1-2-10-13-6-7-15(10)8-9-4-3-5-14-11(9)12/h3-7H,2,8H2,1H3,(H2,12,14).
What are the key properties of 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine?
3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine has a molecular weight of 202.26 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 62465807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).