5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin

C19H34N2O2Sn — CID 140989750

IUPAC5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin
SMILESCCCCC(CCCC)(CCCC)[Sn]c1cc(OC)nc(OC)n1
InChIInChI=1S/C13H27.C6H7N2O2.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-9-5-3-4-7-6(8-5)10-2;/h4-12H2,1-3H3;3H,1-2H3;
InChIKeyHIMGIWMIWBIDIP-UHFFFAOYSA-N
MW441.20 g/mol
LogP4.55
Rot. Bonds13

About 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin

5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin (PubChem CID 140989750) has the molecular formula C19H34N2O2Sn and a molecular weight of 441.20 g/mol. Its IUPAC name is 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin.

Molecular Properties

Compound Name5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin
PubChem CID140989750
Molecular FormulaC19H34N2O2Sn
Molecular Weight441.20 g/mol
Exact Mass442.16
IUPAC Name5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin
SMILESCCCCC(CCCC)(CCCC)[Sn]c1cc(OC)nc(OC)n1
InChIInChI=1S/C13H27.C6H7N2O2.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-9-5-3-4-7-6(8-5)10-2;/h4-12H2,1-3H3;3H,1-2H3;
InChIKeyHIMGIWMIWBIDIP-UHFFFAOYSA-N
XLogP4.55
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.20
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-butylnonan-5-yl-(4-methoxy-2-pyridinyl)tin
CID 141269215
5-butylnonan-5-yl-(3,6-dimethoxypyridazin-4-yl)tin
CID 141228722
5-butylnonan-5-yl-(6-ethoxypyrazin-2-yl)tin
CID 141269173
3-(2,6-dimethoxypyrimidin-4-yl)pentan-3-ol
CID 101048701
5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin
CID 141423609
2,6-dimethoxy-N-propylpyrimidin-4-amine
CID 82670435
5-butylnonan-5-yl-[2-(5-butylnonan-5-yl-λ2-stannanyl)thieno[2,3-f][1]benzothiol-6-yl]tin
CID 141292242
5-butylnonan-5-yl-[4-(5-butylnonan-5-yl-λ2-stannanyl)phenyl]tin
CID 141310885
5-butylnonan-5-yl-(6-propan-2-yl-2-pyridinyl)tin
CID 169099321
5-butylnonan-5-yl-[2-tri(propan-2-yl)silyl-1,3-oxazol-4-yl]tin
CID 176910575
N-decyl-4,6-dimethoxypyrimidin-2-amine
CID 115355214
(5-amino-6-carbamoyl-2-pyridinyl)-(5-butylnonan-5-yl)tin
CID 176893776

Frequently Asked Questions

What is the IUPAC name of 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin?
The IUPAC name of 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin (CID 140989750) is 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin.
What is the SMILES notation for 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin?
The canonical SMILES for 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin is CCCCC(CCCC)(CCCC)[Sn]c1cc(OC)nc(OC)n1.
What is the InChIKey of 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin?
The InChIKey is HIMGIWMIWBIDIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27.C6H7N2O2.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-9-5-3-4-7-6(8-5)10-2;/h4-12H2,1-3H3;3H,1-2H3;.
What are the key properties of 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin?
5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin has a molecular weight of 441.20 g/mol, XLogP of 4.55, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin is sourced from PubChem (CID 140989750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).