N-propan-2-yl-5-tributylstannylpyridin-2-amine

C20H38N2Sn — CID 66934080

IUPACN-propan-2-yl-5-tributylstannylpyridin-2-amine
SMILESCCCC[Sn](CCCC)(CCCC)c1ccc(NC(C)C)nc1
InChIInChI=1S/C8H11N2.3C4H9.Sn/c1-7(2)10-8-5-3-4-6-9-8;3*1-3-4-2;/h3,5-7H,1-2H3,(H,9,10);3*1,3-4H2,2H3;
InChIKeyDZKHYDAFSPRSDG-UHFFFAOYSA-N
MW425.25 g/mol
LogP5.96
Rot. Bonds12

About N-propan-2-yl-5-tributylstannylpyridin-2-amine

N-propan-2-yl-5-tributylstannylpyridin-2-amine (PubChem CID 66934080) has the molecular formula C20H38N2Sn and a molecular weight of 425.25 g/mol. Its IUPAC name is N-propan-2-yl-5-tributylstannylpyridin-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-5-tributylstannylpyridin-2-amine
PubChem CID66934080
Molecular FormulaC20H38N2Sn
Molecular Weight425.25 g/mol
Exact Mass426.21
IUPAC NameN-propan-2-yl-5-tributylstannylpyridin-2-amine
SMILESCCCC[Sn](CCCC)(CCCC)c1ccc(NC(C)C)nc1
InChIInChI=1S/C8H11N2.3C4H9.Sn/c1-7(2)10-8-5-3-4-6-9-8;3*1-3-4-2;/h3,5-7H,1-2H3,(H,9,10);3*1,3-4H2,2H3;
InChIKeyDZKHYDAFSPRSDG-UHFFFAOYSA-N
XLogP5.96
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.25
LogP ≤ 55.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-5-tributylstannylpyridin-2-amine?
The IUPAC name of N-propan-2-yl-5-tributylstannylpyridin-2-amine (CID 66934080) is N-propan-2-yl-5-tributylstannylpyridin-2-amine.
What is the SMILES notation for N-propan-2-yl-5-tributylstannylpyridin-2-amine?
The canonical SMILES for N-propan-2-yl-5-tributylstannylpyridin-2-amine is CCCC[Sn](CCCC)(CCCC)c1ccc(NC(C)C)nc1.
What is the InChIKey of N-propan-2-yl-5-tributylstannylpyridin-2-amine?
The InChIKey is DZKHYDAFSPRSDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N2.3C4H9.Sn/c1-7(2)10-8-5-3-4-6-9-8;3*1-3-4-2;/h3,5-7H,1-2H3,(H,9,10);3*1,3-4H2,2H3;.
What are the key properties of N-propan-2-yl-5-tributylstannylpyridin-2-amine?
N-propan-2-yl-5-tributylstannylpyridin-2-amine has a molecular weight of 425.25 g/mol, XLogP of 5.96, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-5-tributylstannylpyridin-2-amine is sourced from PubChem (CID 66934080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).