5-(1H-indol-6-yl)-1H-pyrazol-3-amine

C11H10N4 — CID 117287823

IUPAC5-(1H-indol-6-yl)-1H-pyrazol-3-amine
SMILESNc1cc(-c2ccc3cc[nH]c3c2)[nH]n1
InChIInChI=1S/C11H10N4/c12-11-6-10(14-15-11)8-2-1-7-3-4-13-9(7)5-8/h1-6,13H,(H3,12,14,15)
InChIKeyWGNBSWSUVHVDSW-UHFFFAOYSA-N
MW198.23 g/mol
LogP2.14
Rot. Bonds1

About 5-(1H-indol-6-yl)-1H-pyrazol-3-amine

5-(1H-indol-6-yl)-1H-pyrazol-3-amine (PubChem CID 117287823) has the molecular formula C11H10N4 and a molecular weight of 198.23 g/mol. Its IUPAC name is 5-(1H-indol-6-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(1H-indol-6-yl)-1H-pyrazol-3-amine
PubChem CID117287823
Molecular FormulaC11H10N4
Molecular Weight198.23 g/mol
Exact Mass198.09
IUPAC Name5-(1H-indol-6-yl)-1H-pyrazol-3-amine
SMILESNc1cc(-c2ccc3cc[nH]c3c2)[nH]n1
InChIInChI=1S/C11H10N4/c12-11-6-10(14-15-11)8-2-1-7-3-4-13-9(7)5-8/h1-6,13H,(H3,12,14,15)
InChIKeyWGNBSWSUVHVDSW-UHFFFAOYSA-N
XLogP2.14
TPSA70.49 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 52.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(1H-indol-6-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(1H-indol-6-yl)-1H-pyrazol-3-amine (CID 117287823) is 5-(1H-indol-6-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(1H-indol-6-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(1H-indol-6-yl)-1H-pyrazol-3-amine is Nc1cc(-c2ccc3cc[nH]c3c2)[nH]n1.
What is the InChIKey of 5-(1H-indol-6-yl)-1H-pyrazol-3-amine?
The InChIKey is WGNBSWSUVHVDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4/c12-11-6-10(14-15-11)8-2-1-7-3-4-13-9(7)5-8/h1-6,13H,(H3,12,14,15).
What are the key properties of 5-(1H-indol-6-yl)-1H-pyrazol-3-amine?
5-(1H-indol-6-yl)-1H-pyrazol-3-amine has a molecular weight of 198.23 g/mol, XLogP of 2.14, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-indol-6-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 117287823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).