5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine

C24H38FN3Sn — CID 150159941

IUPAC5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine
SMILESCCCC[Sn](CCCC)(CCCC)c1ccc(-c2ccc(N(C)C)nc2)nc1F
InChIInChI=1S/C12H11FN3.3C4H9.Sn/c1-16(2)12-7-6-9(8-14-12)10-4-3-5-11(13)15-10;3*1-3-4-2;/h3-4,6-8H,1-2H3;3*1,3-4H2,2H3;
InChIKeyFHAUWBXHBKGSPW-UHFFFAOYSA-N
MW506.30 g/mol
LogP6.40
Rot. Bonds12

About 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine

5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine (PubChem CID 150159941) has the molecular formula C24H38FN3Sn and a molecular weight of 506.30 g/mol. Its IUPAC name is 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine
PubChem CID150159941
Molecular FormulaC24H38FN3Sn
Molecular Weight506.30 g/mol
Exact Mass507.21
IUPAC Name5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine
SMILESCCCC[Sn](CCCC)(CCCC)c1ccc(-c2ccc(N(C)C)nc2)nc1F
InChIInChI=1S/C12H11FN3.3C4H9.Sn/c1-16(2)12-7-6-9(8-14-12)10-4-3-5-11(13)15-10;3*1-3-4-2;/h3-4,6-8H,1-2H3;3*1,3-4H2,2H3;
InChIKeyFHAUWBXHBKGSPW-UHFFFAOYSA-N
XLogP6.40
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.30
LogP ≤ 56.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N,N-dimethylpyridin-2-amine
CID 59800676
5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine
CID 144834039
2-N,2-N-dimethyl-5-N-undecan-6-ylpyridine-2,5-diamine
CID 43782595
2-azabicyclo[2.2.0]hexa-1,3,5-triene;N,N-dimethylethanamine
CID 175018575
tributyl-(4-chloro-2-fluorophenyl)stannane
CID 139884549
2-fluoro-6-(6-propyl-3-pyridinyl)pyridine
CID 143839738
N,N-diethyl-5-tributylstannylpyrazin-2-amine
CID 59694015
5-[6-(dimethylamino)-3-pyridinyl]-1-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridin-2-one
CID 54761749
N,N-dimethyl-5-propylpyridin-2-amine
CID 23544386
2-fluoro-3-heptyl-6-[4-(4-heptylphenyl)phenyl]pyridine
CID 91063743
3-decyl-2-fluoro-6-[4-(4-hexylphenyl)phenyl]pyridine
CID 91526476
5-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)-N,N-dimethylpyridin-2-amine
CID 44555284

Frequently Asked Questions

What is the IUPAC name of 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine?
The IUPAC name of 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine (CID 150159941) is 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine is CCCC[Sn](CCCC)(CCCC)c1ccc(-c2ccc(N(C)C)nc2)nc1F.
What is the InChIKey of 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine?
The InChIKey is FHAUWBXHBKGSPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN3.3C4H9.Sn/c1-16(2)12-7-6-9(8-14-12)10-4-3-5-11(13)15-10;3*1-3-4-2;/h3-4,6-8H,1-2H3;3*1,3-4H2,2H3;.
What are the key properties of 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine?
5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine has a molecular weight of 506.30 g/mol, XLogP of 6.40, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-fluoro-5-tributylstannyl-2-pyridinyl)-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 150159941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).