piperidin-1-yl(tributylstannyl)methanone

C18H37NOSn — CID 11036834

IUPACpiperidin-1-yl(tributylstannyl)methanone
SMILESCCCC[Sn](CCCC)(CCCC)C(=O)N1CCCCC1
InChIInChI=1S/C6H10NO.3C4H9.Sn/c8-6-7-4-2-1-3-5-7;3*1-3-4-2;/h1-5H2;3*1,3-4H2,2H3;
InChIKeyQCNWGYRPPSMSCT-UHFFFAOYSA-N
MW402.21 g/mol
LogP6.02
Rot. Bonds10

About piperidin-1-yl(tributylstannyl)methanone

piperidin-1-yl(tributylstannyl)methanone (PubChem CID 11036834) has the molecular formula C18H37NOSn and a molecular weight of 402.21 g/mol. Its IUPAC name is piperidin-1-yl(tributylstannyl)methanone.

Molecular Properties

Compound Namepiperidin-1-yl(tributylstannyl)methanone
PubChem CID11036834
Molecular FormulaC18H37NOSn
Molecular Weight402.21 g/mol
Exact Mass403.19
IUPAC Namepiperidin-1-yl(tributylstannyl)methanone
SMILESCCCC[Sn](CCCC)(CCCC)C(=O)N1CCCCC1
InChIInChI=1S/C6H10NO.3C4H9.Sn/c8-6-7-4-2-1-3-5-7;3*1-3-4-2;/h1-5H2;3*1,3-4H2,2H3;
InChIKeyQCNWGYRPPSMSCT-UHFFFAOYSA-N
XLogP6.02
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.21
LogP ≤ 56.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze piperidin-1-yl(tributylstannyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of piperidin-1-yl(tributylstannyl)methanone?
The IUPAC name of piperidin-1-yl(tributylstannyl)methanone (CID 11036834) is piperidin-1-yl(tributylstannyl)methanone.
What is the SMILES notation for piperidin-1-yl(tributylstannyl)methanone?
The canonical SMILES for piperidin-1-yl(tributylstannyl)methanone is CCCC[Sn](CCCC)(CCCC)C(=O)N1CCCCC1.
What is the InChIKey of piperidin-1-yl(tributylstannyl)methanone?
The InChIKey is QCNWGYRPPSMSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10NO.3C4H9.Sn/c8-6-7-4-2-1-3-5-7;3*1-3-4-2;/h1-5H2;3*1,3-4H2,2H3;.
What are the key properties of piperidin-1-yl(tributylstannyl)methanone?
piperidin-1-yl(tributylstannyl)methanone has a molecular weight of 402.21 g/mol, XLogP of 6.02, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl(tributylstannyl)methanone is sourced from PubChem (CID 11036834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).