azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane

C34H52N2O2Sn — CID 175081756

IUPACazane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cc(C)c(Cc2ccc(OC)cc2)c(Cc2ccc(OC)cc2)n1.N
InChIInChI=1S/C22H22NO2.3C4H9.H3N.Sn/c1-16-12-13-23-22(15-18-6-10-20(25-3)11-7-18)21(16)14-17-4-8-19(24-2)9-5-17;3*1-3-4-2;;/h4-12H,14-15H2,1-3H3;3*1,3-4H2,2H3;1H3;
InChIKeyBCARSSKJDNUFIF-UHFFFAOYSA-N
MW639.51 g/mol
LogP8.81
Rot. Bonds16

About azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane

azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane (PubChem CID 175081756) has the molecular formula C34H52N2O2Sn and a molecular weight of 639.51 g/mol. Its IUPAC name is azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane.

Molecular Properties

Compound Nameazane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane
PubChem CID175081756
Molecular FormulaC34H52N2O2Sn
Molecular Weight639.51 g/mol
Exact Mass640.31
IUPAC Nameazane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cc(C)c(Cc2ccc(OC)cc2)c(Cc2ccc(OC)cc2)n1.N
InChIInChI=1S/C22H22NO2.3C4H9.H3N.Sn/c1-16-12-13-23-22(15-18-6-10-20(25-3)11-7-18)21(16)14-17-4-8-19(24-2)9-5-17;3*1-3-4-2;;/h4-12H,14-15H2,1-3H3;3*1,3-4H2,2H3;1H3;
InChIKeyBCARSSKJDNUFIF-UHFFFAOYSA-N
XLogP8.81
TPSA66.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500639.51
LogP ≤ 58.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tributyl-(4-methoxyphenyl)stannane
CID 2762547
1-butoxy-4-[(4-methoxyphenyl)methyl]benzene
CID 145063136
tributyl-(3-methoxy-5-methylphenyl)stannane
CID 159276373
6-bromo-3,5-bis[(4-methoxyphenyl)methyl]-4-methylpyridin-2-amine
CID 169224423
4-methoxy-1-[(4-methoxyphenyl)methyl]-2-methylbenzene
CID 15654338
1-methoxy-4-[(4-propylphenyl)methyl]benzene
CID 67608407
1,2,3,4-tetrakis[(4-methoxyphenyl)methyl]benzene
CID 175327763
2-ethyl-5-[(4-methoxyphenyl)methyl]-3-methylfuran
CID 25243035
4-[(4-methoxyphenyl)methyl]-5-methylbenzene-1,3-dicarboxylic acid
CID 150160399
4-butylsulfanyl-6-chloro-5-[(4-methoxyphenyl)methyl]-2-methylsulfanylpyrimidine
CID 146154392
CID 174269640
CID 174269640
1,2,3,4-tetramethoxy-5-[(4-methoxyphenyl)methyl]-6-methylbenzene
CID 142654799

Frequently Asked Questions

What is the IUPAC name of azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane?
The IUPAC name of azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane (CID 175081756) is azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane.
What is the SMILES notation for azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane?
The canonical SMILES for azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane is CCCC[Sn](CCCC)(CCCC)c1cc(C)c(Cc2ccc(OC)cc2)c(Cc2ccc(OC)cc2)n1.N.
What is the InChIKey of azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane?
The InChIKey is BCARSSKJDNUFIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22NO2.3C4H9.H3N.Sn/c1-16-12-13-23-22(15-18-6-10-20(25-3)11-7-18)21(16)14-17-4-8-19(24-2)9-5-17;3*1-3-4-2;;/h4-12H,14-15H2,1-3H3;3*1,3-4H2,2H3;1H3;.
What are the key properties of azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane?
azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane has a molecular weight of 639.51 g/mol, XLogP of 8.81, 16 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;[5,6-bis[(4-methoxyphenyl)methyl]-4-methyl-2-pyridinyl]-tributylstannane is sourced from PubChem (CID 175081756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).