(4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine

C8H13N3 — CID 143108130

IUPAC(4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine
SMILESC=Cc1nc(CN)[nH]c1CC
InChIInChI=1S/C8H13N3/c1-3-6-7(4-2)11-8(5-9)10-6/h3H,1,4-5,9H2,2H3,(H,10,11)
InChIKeyAYCZTXXEMZIEKZ-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.07
Rot. Bonds3

About (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine

(4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine (PubChem CID 143108130) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine.

Molecular Properties

Compound Name(4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine
PubChem CID143108130
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name(4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine
SMILESC=Cc1nc(CN)[nH]c1CC
InChIInChI=1S/C8H13N3/c1-3-6-7(4-2)11-8(5-9)10-6/h3H,1,4-5,9H2,2H3,(H,10,11)
InChIKeyAYCZTXXEMZIEKZ-UHFFFAOYSA-N
XLogP1.07
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine?
The IUPAC name of (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine (CID 143108130) is (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine.
What is the SMILES notation for (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine?
The canonical SMILES for (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine is C=Cc1nc(CN)[nH]c1CC.
What is the InChIKey of (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine?
The InChIKey is AYCZTXXEMZIEKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-3-6-7(4-2)11-8(5-9)10-6/h3H,1,4-5,9H2,2H3,(H,10,11).
What are the key properties of (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine?
(4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine has a molecular weight of 151.21 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethenyl-5-ethyl-1H-imidazol-2-yl)methanamine is sourced from PubChem (CID 143108130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).