5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine

C10H15N5 — CID 165499967

IUPAC5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine
SMILESCC(C)Cc1c(N)n[nH]c1-c1cnc[nH]1
InChIInChI=1S/C10H15N5/c1-6(2)3-7-9(14-15-10(7)11)8-4-12-5-13-8/h4-6H,3H2,1-2H3,(H,12,13)(H3,11,14,15)
InChIKeyXFIYAIPKFFDAQF-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.58
Rot. Bonds3

About 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine

5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine (PubChem CID 165499967) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine
PubChem CID165499967
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine
SMILESCC(C)Cc1c(N)n[nH]c1-c1cnc[nH]1
InChIInChI=1S/C10H15N5/c1-6(2)3-7-9(14-15-10(7)11)8-4-12-5-13-8/h4-6H,3H2,1-2H3,(H,12,13)(H3,11,14,15)
InChIKeyXFIYAIPKFFDAQF-UHFFFAOYSA-N
XLogP1.58
TPSA83.38 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine (CID 165499967) is 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine is CC(C)Cc1c(N)n[nH]c1-c1cnc[nH]1.
What is the InChIKey of 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine?
The InChIKey is XFIYAIPKFFDAQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-6(2)3-7-9(14-15-10(7)11)8-4-12-5-13-8/h4-6H,3H2,1-2H3,(H,12,13)(H3,11,14,15).
What are the key properties of 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine?
5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine has a molecular weight of 205.26 g/mol, XLogP of 1.58, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-imidazol-5-yl)-4-(2-methylpropyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 165499967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).