spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane]

C15H17N3 — CID 155809673

IUPACspiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane]
SMILESc1ccc2c(c1)NC1(CCCCC1)n1nccc1-2
InChIInChI=1S/C15H17N3/c1-4-9-15(10-5-1)17-13-7-3-2-6-12(13)14-8-11-16-18(14)15/h2-3,6-8,11,17H,1,4-5,9-10H2
InChIKeyIVHOFBKMXNIOMQ-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.59
Rot. Bonds

About spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane]

spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane] (PubChem CID 155809673) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane].

Molecular Properties

Compound Namespiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane]
PubChem CID155809673
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Namespiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane]
SMILESc1ccc2c(c1)NC1(CCCCC1)n1nccc1-2
InChIInChI=1S/C15H17N3/c1-4-9-15(10-5-1)17-13-7-3-2-6-12(13)14-8-11-16-18(14)15/h2-3,6-8,11,17H,1,4-5,9-10H2
InChIKeyIVHOFBKMXNIOMQ-UHFFFAOYSA-N
XLogP3.59
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane]?
The IUPAC name of spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane] (CID 155809673) is spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane].
What is the SMILES notation for spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane]?
The canonical SMILES for spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane] is c1ccc2c(c1)NC1(CCCCC1)n1nccc1-2.
What is the InChIKey of spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane]?
The InChIKey is IVHOFBKMXNIOMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-4-9-15(10-5-1)17-13-7-3-2-6-12(13)14-8-11-16-18(14)15/h2-3,6-8,11,17H,1,4-5,9-10H2.
What are the key properties of spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane]?
spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane] has a molecular weight of 239.32 g/mol, XLogP of 3.59, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[6H-pyrazolo[1,5-c]quinazoline-5,1'-cyclohexane] is sourced from PubChem (CID 155809673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).