5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine

C6H9N5 — CID 70599152

IUPAC5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine
SMILESNC1=NCC(c2ccn[nH]2)N1
InChIInChI=1S/C6H9N5/c7-6-8-3-5(10-6)4-1-2-9-11-4/h1-2,5H,3H2,(H,9,11)(H3,7,8,10)
InChIKeyFCAQLVHPXOTEEX-UHFFFAOYSA-N
MW151.17 g/mol
LogP-0.63
Rot. Bonds1

About 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine

5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 70599152) has the molecular formula C6H9N5 and a molecular weight of 151.17 g/mol. Its IUPAC name is 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID70599152
Molecular FormulaC6H9N5
Molecular Weight151.17 g/mol
Exact Mass151.09
IUPAC Name5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine
SMILESNC1=NCC(c2ccn[nH]2)N1
InChIInChI=1S/C6H9N5/c7-6-8-3-5(10-6)4-1-2-9-11-4/h1-2,5H,3H2,(H,9,11)(H3,7,8,10)
InChIKeyFCAQLVHPXOTEEX-UHFFFAOYSA-N
XLogP-0.63
TPSA79.09 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 5-0.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine (CID 70599152) is 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine is NC1=NCC(c2ccn[nH]2)N1.
What is the InChIKey of 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is FCAQLVHPXOTEEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N5/c7-6-8-3-5(10-6)4-1-2-9-11-4/h1-2,5H,3H2,(H,9,11)(H3,7,8,10).
What are the key properties of 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine?
5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 151.17 g/mol, XLogP of -0.63, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-pyrazol-5-yl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 70599152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).