pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin

C15H24N2Sn — CID 163522103

IUPACpent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin
SMILESC=C(CCC)[Sn]c1nn(C)c2c1CC(C)(C)CC2
InChIInChI=1S/C10H15N2.C5H9.Sn/c1-10(2)5-4-9-8(6-10)7-11-12(9)3;1-3-5-4-2;/h4-6H2,1-3H3;1,4-5H2,2H3;
InChIKeyDLSMCLSBCXZXCN-UHFFFAOYSA-N
MW351.08 g/mol
LogP2.58
Rot. Bonds4

About pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin

pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin (PubChem CID 163522103) has the molecular formula C15H24N2Sn and a molecular weight of 351.08 g/mol. Its IUPAC name is pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin.

Molecular Properties

Compound Namepent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin
PubChem CID163522103
Molecular FormulaC15H24N2Sn
Molecular Weight351.08 g/mol
Exact Mass352.10
IUPAC Namepent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin
SMILESC=C(CCC)[Sn]c1nn(C)c2c1CC(C)(C)CC2
InChIInChI=1S/C10H15N2.C5H9.Sn/c1-10(2)5-4-9-8(6-10)7-11-12(9)3;1-3-5-4-2;/h4-6H2,1-3H3;1,4-5H2,2H3;
InChIKeyDLSMCLSBCXZXCN-UHFFFAOYSA-N
XLogP2.58
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.08
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin?
The IUPAC name of pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin (CID 163522103) is pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin.
What is the SMILES notation for pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin?
The canonical SMILES for pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin is C=C(CCC)[Sn]c1nn(C)c2c1CC(C)(C)CC2.
What is the InChIKey of pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin?
The InChIKey is DLSMCLSBCXZXCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N2.C5H9.Sn/c1-10(2)5-4-9-8(6-10)7-11-12(9)3;1-3-5-4-2;/h4-6H2,1-3H3;1,4-5H2,2H3;.
What are the key properties of pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin?
pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin has a molecular weight of 351.08 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pent-1-en-2-yl-(1,5,5-trimethyl-6,7-dihydro-4H-indazol-3-yl)tin is sourced from PubChem (CID 163522103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).