trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane

C19H28N2O2Sn — CID 169236547

IUPACtrimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane
SMILESCC1(Oc2ccc3c(c2)c([Sn](C)(C)C)nn3C2CCCCO2)CC1
InChIInChI=1S/C16H19N2O2.3CH3.Sn/c1-16(7-8-16)20-13-5-6-14-12(10-13)11-17-18(14)15-4-2-3-9-19-15;;;;/h5-6,10,15H,2-4,7-9H2,1H3;3*1H3;
InChIKeyREFWRRCBBLJDEU-UHFFFAOYSA-N
MW435.16 g/mol
LogP4.21
Rot. Bonds4

About trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane

trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane (PubChem CID 169236547) has the molecular formula C19H28N2O2Sn and a molecular weight of 435.16 g/mol. Its IUPAC name is trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane.

Molecular Properties

Compound Nametrimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane
PubChem CID169236547
Molecular FormulaC19H28N2O2Sn
Molecular Weight435.16 g/mol
Exact Mass436.12
IUPAC Nametrimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane
SMILESCC1(Oc2ccc3c(c2)c([Sn](C)(C)C)nn3C2CCCCO2)CC1
InChIInChI=1S/C16H19N2O2.3CH3.Sn/c1-16(7-8-16)20-13-5-6-14-12(10-13)11-17-18(14)15-4-2-3-9-19-15;;;;/h5-6,10,15H,2-4,7-9H2,1H3;3*1H3;
InChIKeyREFWRRCBBLJDEU-UHFFFAOYSA-N
XLogP4.21
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.16
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane?
The IUPAC name of trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane (CID 169236547) is trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane.
What is the SMILES notation for trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane?
The canonical SMILES for trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane is CC1(Oc2ccc3c(c2)c([Sn](C)(C)C)nn3C2CCCCO2)CC1.
What is the InChIKey of trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane?
The InChIKey is REFWRRCBBLJDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N2O2.3CH3.Sn/c1-16(7-8-16)20-13-5-6-14-12(10-13)11-17-18(14)15-4-2-3-9-19-15;;;;/h5-6,10,15H,2-4,7-9H2,1H3;3*1H3;.
What are the key properties of trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane?
trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane has a molecular weight of 435.16 g/mol, XLogP of 4.21, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[5-(1-methylcyclopropyl)oxy-1-(oxan-2-yl)indazol-3-yl]stannane is sourced from PubChem (CID 169236547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).