8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide

C15H20ClN5O2S — CID 121326161

IUPAC8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide
SMILESNS(=O)(=O)N1CCC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)C1
InChIInChI=1S/C15H20ClN5O2S/c16-11-7-13-12(9-18-19-13)14(8-11)20-4-1-15(2-5-20)3-6-21(10-15)24(17,22)23/h7-9H,1-6,10H2,(H,18,19)(H2,17,22,23)
InChIKeyILDNLKUXZYQSPQ-UHFFFAOYSA-N
MW369.88 g/mol
LogP1.71
Rot. Bonds2

About 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide

8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide (PubChem CID 121326161) has the molecular formula C15H20ClN5O2S and a molecular weight of 369.88 g/mol. Its IUPAC name is 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide.

Molecular Properties

Compound Name8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide
PubChem CID121326161
Molecular FormulaC15H20ClN5O2S
Molecular Weight369.88 g/mol
Exact Mass369.10
IUPAC Name8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide
SMILESNS(=O)(=O)N1CCC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)C1
InChIInChI=1S/C15H20ClN5O2S/c16-11-7-13-12(9-18-19-13)14(8-11)20-4-1-15(2-5-20)3-6-21(10-15)24(17,22)23/h7-9H,1-6,10H2,(H,18,19)(H2,17,22,23)
InChIKeyILDNLKUXZYQSPQ-UHFFFAOYSA-N
XLogP1.71
TPSA95.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.88
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide?
The IUPAC name of 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide (CID 121326161) is 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide.
What is the SMILES notation for 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide?
The canonical SMILES for 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide is NS(=O)(=O)N1CCC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)C1.
What is the InChIKey of 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide?
The InChIKey is ILDNLKUXZYQSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN5O2S/c16-11-7-13-12(9-18-19-13)14(8-11)20-4-1-15(2-5-20)3-6-21(10-15)24(17,22)23/h7-9H,1-6,10H2,(H,18,19)(H2,17,22,23).
What are the key properties of 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide?
8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide has a molecular weight of 369.88 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(6-chloro-1H-indazol-4-yl)-2,8-diazaspiro[4.5]decane-2-sulfonamide is sourced from PubChem (CID 121326161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).