4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine

C19H33NSi — CID 103437694

IUPAC4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine
SMILESCCCC1CCC(NCc2ccc([Si](C)(C)C)cc2)CC1
InChIInChI=1S/C19H33NSi/c1-5-6-16-7-11-18(12-8-16)20-15-17-9-13-19(14-10-17)21(2,3)4/h9-10,13-14,16,18,20H,5-8,11-12,15H2,1-4H3
InChIKeyKNMUFDUXXSCTBF-UHFFFAOYSA-N
MW303.57 g/mol
LogP4.68
Rot. Bonds6

About 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine

4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine (PubChem CID 103437694) has the molecular formula C19H33NSi and a molecular weight of 303.57 g/mol. Its IUPAC name is 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine
PubChem CID103437694
Molecular FormulaC19H33NSi
Molecular Weight303.57 g/mol
Exact Mass303.24
IUPAC Name4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine
SMILESCCCC1CCC(NCc2ccc([Si](C)(C)C)cc2)CC1
InChIInChI=1S/C19H33NSi/c1-5-6-16-7-11-18(12-8-16)20-15-17-9-13-19(14-10-17)21(2,3)4/h9-10,13-14,16,18,20H,5-8,11-12,15H2,1-4H3
InChIKeyKNMUFDUXXSCTBF-UHFFFAOYSA-N
XLogP4.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.57
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine?
The IUPAC name of 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine (CID 103437694) is 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine is CCCC1CCC(NCc2ccc([Si](C)(C)C)cc2)CC1.
What is the InChIKey of 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine?
The InChIKey is KNMUFDUXXSCTBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33NSi/c1-5-6-16-7-11-18(12-8-16)20-15-17-9-13-19(14-10-17)21(2,3)4/h9-10,13-14,16,18,20H,5-8,11-12,15H2,1-4H3.
What are the key properties of 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine?
4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine has a molecular weight of 303.57 g/mol, XLogP of 4.68, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-N-[(4-trimethylsilylphenyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 103437694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).