N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine

C20H41N3Sn — CID 22609848

IUPACN,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine
SMILESCCCC[Sn](CCCC)(CCCC)c1nccn1C(CC)N(C)C
InChIInChI=1S/C8H14N3.3C4H9.Sn/c1-4-8(10(2)3)11-6-5-9-7-11;3*1-3-4-2;/h5-6,8H,4H2,1-3H3;3*1,3-4H2,2H3;
InChIKeyBCDFHHJJWBAVDR-UHFFFAOYSA-N
MW442.28 g/mol
LogP5.41
Rot. Bonds13

About N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine

N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine (PubChem CID 22609848) has the molecular formula C20H41N3Sn and a molecular weight of 442.28 g/mol. Its IUPAC name is N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine
PubChem CID22609848
Molecular FormulaC20H41N3Sn
Molecular Weight442.28 g/mol
Exact Mass443.23
IUPAC NameN,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine
SMILESCCCC[Sn](CCCC)(CCCC)c1nccn1C(CC)N(C)C
InChIInChI=1S/C8H14N3.3C4H9.Sn/c1-4-8(10(2)3)11-6-5-9-7-11;3*1-3-4-2;/h5-6,8H,4H2,1-3H3;3*1,3-4H2,2H3;
InChIKeyBCDFHHJJWBAVDR-UHFFFAOYSA-N
XLogP5.41
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.28
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine?
The IUPAC name of N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine (CID 22609848) is N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine?
The canonical SMILES for N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine is CCCC[Sn](CCCC)(CCCC)c1nccn1C(CC)N(C)C.
What is the InChIKey of N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine?
The InChIKey is BCDFHHJJWBAVDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N3.3C4H9.Sn/c1-4-8(10(2)3)11-6-5-9-7-11;3*1-3-4-2;/h5-6,8H,4H2,1-3H3;3*1,3-4H2,2H3;.
What are the key properties of N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine?
N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine has a molecular weight of 442.28 g/mol, XLogP of 5.41, 13 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(2-tributylstannylimidazol-1-yl)propan-1-amine is sourced from PubChem (CID 22609848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).