(Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide

C24H48N2O4Sn — CID 177480377

IUPAC(Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide
SMILESCCCC[Sn](CCCC)(CCCC)/C(=C\CCC(=O)N(C)OC)CCC(=O)N(C)OC
InChIInChI=1S/C12H21N2O4.3C4H9.Sn/c1-13(17-3)11(15)9-7-5-6-8-10-12(16)14(2)18-4;3*1-3-4-2;/h5H,7-10H2,1-4H3;3*1,3-4H2,2H3;
InChIKeyWQPFRPRUVJCSMP-UHFFFAOYSA-N
MW547.37 g/mol
LogP5.90
Rot. Bonds18

About (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide

(Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide (PubChem CID 177480377) has the molecular formula C24H48N2O4Sn and a molecular weight of 547.37 g/mol. Its IUPAC name is (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide.

Molecular Properties

Compound Name(Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide
PubChem CID177480377
Molecular FormulaC24H48N2O4Sn
Molecular Weight547.37 g/mol
Exact Mass548.26
IUPAC Name(Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide
SMILESCCCC[Sn](CCCC)(CCCC)/C(=C\CCC(=O)N(C)OC)CCC(=O)N(C)OC
InChIInChI=1S/C12H21N2O4.3C4H9.Sn/c1-13(17-3)11(15)9-7-5-6-8-10-12(16)14(2)18-4;3*1-3-4-2;/h5H,7-10H2,1-4H3;3*1,3-4H2,2H3;
InChIKeyWQPFRPRUVJCSMP-UHFFFAOYSA-N
XLogP5.90
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds18
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500547.37
LogP ≤ 55.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methoxy-N-methyl-4-oxononanamide
CID 121217701
(Z)-N-methoxy-N-methyloctadec-9-enamide
CID 10903483
[4-[methoxy(methyl)amino]-4-oxobutanoyl]azanide;palladium
CID 162387878
(E)-3-tributylstannylhex-2-en-1-ol
CID 10362882
(20Z,23Z)-N,N-dimethylnonacosa-20,23-dien-10-amine;(11Z,14Z)-N-methoxy-N-methylicosa-11,14-dienamide
CID 161442718
N-methoxy-N-methylpropanamide
CID 11344007
4-bromo-N-methoxy-N-methylpent-4-enamide
CID 91756940
[(E)-4-acetyloxy-3-tributylstannylbut-2-enyl] acetate
CID 13468497
N-methoxy-N,5,5-trimethylhexanamide
CID 89296256
(2E,4E)-N-methoxy-N-methyl-6-oxodeca-2,4-dienamide
CID 141437196
2-[acetyl(butyl)amino]-N-methoxy-N-methylacetamide
CID 54528314
3-tributylstannylpent-3-en-1-ol
CID 86034571

Frequently Asked Questions

What is the IUPAC name of (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide?
The IUPAC name of (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide (CID 177480377) is (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide.
What is the SMILES notation for (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide?
The canonical SMILES for (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide is CCCC[Sn](CCCC)(CCCC)/C(=C\CCC(=O)N(C)OC)CCC(=O)N(C)OC.
What is the InChIKey of (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide?
The InChIKey is WQPFRPRUVJCSMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N2O4.3C4H9.Sn/c1-13(17-3)11(15)9-7-5-6-8-10-12(16)14(2)18-4;3*1-3-4-2;/h5H,7-10H2,1-4H3;3*1,3-4H2,2H3;.
What are the key properties of (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide?
(Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide has a molecular weight of 547.37 g/mol, XLogP of 5.90, 18 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N'-dimethoxy-N,N'-dimethyl-4-tributylstannyloct-4-enediamide is sourced from PubChem (CID 177480377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).