N-cyclohexyl-1-tributylstannylpropan-1-imine

C21H43NSn — CID 10862873

IUPACN-cyclohexyl-1-tributylstannylpropan-1-imine
SMILESCCCC[Sn](CCCC)(CCCC)/C(CC)=N/C1CCCCC1
InChIInChI=1S/C9H16N.3C4H9.Sn/c1-2-8-10-9-6-4-3-5-7-9;3*1-3-4-2;/h9H,2-7H2,1H3;3*1,3-4H2,2H3;
InChIKeySCKJQZFSFREJKC-UHFFFAOYSA-N
MW428.29 g/mol
LogP7.56
Rot. Bonds12

About N-cyclohexyl-1-tributylstannylpropan-1-imine

N-cyclohexyl-1-tributylstannylpropan-1-imine (PubChem CID 10862873) has the molecular formula C21H43NSn and a molecular weight of 428.29 g/mol. Its IUPAC name is N-cyclohexyl-1-tributylstannylpropan-1-imine.

Molecular Properties

Compound NameN-cyclohexyl-1-tributylstannylpropan-1-imine
PubChem CID10862873
Molecular FormulaC21H43NSn
Molecular Weight428.29 g/mol
Exact Mass429.24
IUPAC NameN-cyclohexyl-1-tributylstannylpropan-1-imine
SMILESCCCC[Sn](CCCC)(CCCC)/C(CC)=N/C1CCCCC1
InChIInChI=1S/C9H16N.3C4H9.Sn/c1-2-8-10-9-6-4-3-5-7-9;3*1-3-4-2;/h9H,2-7H2,1H3;3*1,3-4H2,2H3;
InChIKeySCKJQZFSFREJKC-UHFFFAOYSA-N
XLogP7.56
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.29
LogP ≤ 57.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

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N-amino-N'-cyclohexylpropanimidamide
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2-cyclohexyl-1-octan-4-ylguanidine
CID 106025617
2-(N'-cyclohexylcarbamimidoyl)-1-hexyl-1-methylguanidine
CID 174660091
2-cyclohexyl-1-methyl-1-pentan-3-ylguanidine
CID 62362276
2-cyclohexylimino-N,N-dimethylbutan-1-amine
CID 123240449
2-cyclopentyl-1-propan-2-yl-1-propylguanidine
CID 62362054
N-cyclooctyl-1-triethylsilylethanimine
CID 101358854
2-cyclohexyl-1,1-bis(2-methylpropyl)guanidine
CID 62362061
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CID 10929055

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-tributylstannylpropan-1-imine?
The IUPAC name of N-cyclohexyl-1-tributylstannylpropan-1-imine (CID 10862873) is N-cyclohexyl-1-tributylstannylpropan-1-imine.
What is the SMILES notation for N-cyclohexyl-1-tributylstannylpropan-1-imine?
The canonical SMILES for N-cyclohexyl-1-tributylstannylpropan-1-imine is CCCC[Sn](CCCC)(CCCC)/C(CC)=N/C1CCCCC1.
What is the InChIKey of N-cyclohexyl-1-tributylstannylpropan-1-imine?
The InChIKey is SCKJQZFSFREJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N.3C4H9.Sn/c1-2-8-10-9-6-4-3-5-7-9;3*1-3-4-2;/h9H,2-7H2,1H3;3*1,3-4H2,2H3;.
What are the key properties of N-cyclohexyl-1-tributylstannylpropan-1-imine?
N-cyclohexyl-1-tributylstannylpropan-1-imine has a molecular weight of 428.29 g/mol, XLogP of 7.56, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-tributylstannylpropan-1-imine is sourced from PubChem (CID 10862873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).