5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine

C10H15N5 — CID 79497687

IUPAC5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
SMILESC=CCN1C(N)=NCC1c1cnn(C)c1
InChIInChI=1S/C10H15N5/c1-3-4-15-9(6-12-10(15)11)8-5-13-14(2)7-8/h3,5,7,9H,1,4,6H2,2H3,(H2,11,12)
InChIKeyGODHJIXBJKMNIW-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.28
Rot. Bonds3

About 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine

5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine (PubChem CID 79497687) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
PubChem CID79497687
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
SMILESC=CCN1C(N)=NCC1c1cnn(C)c1
InChIInChI=1S/C10H15N5/c1-3-4-15-9(6-12-10(15)11)8-5-13-14(2)7-8/h3,5,7,9H,1,4,6H2,2H3,(H2,11,12)
InChIKeyGODHJIXBJKMNIW-UHFFFAOYSA-N
XLogP0.28
TPSA59.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine (CID 79497687) is 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine is C=CCN1C(N)=NCC1c1cnn(C)c1.
What is the InChIKey of 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine?
The InChIKey is GODHJIXBJKMNIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-3-4-15-9(6-12-10(15)11)8-5-13-14(2)7-8/h3,5,7,9H,1,4,6H2,2H3,(H2,11,12).
What are the key properties of 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine?
5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine has a molecular weight of 205.26 g/mol, XLogP of 0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79497687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).