N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine

C25H39NSi — CID 164683846

IUPACN-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine
SMILESCC[Si](CC)(CC)C(CCCCc1ccccc1)N(C)Cc1ccccc1
InChIInChI=1S/C25H39NSi/c1-5-27(6-2,7-3)25(26(4)22-24-19-12-9-13-20-24)21-15-14-18-23-16-10-8-11-17-23/h8-13,16-17,19-20,25H,5-7,14-15,18,21-22H2,1-4H3
InChIKeyHWZLPDXLQHLZAX-UHFFFAOYSA-N
MW381.68 g/mol
LogP6.95
Rot. Bonds12

About N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine

N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine (PubChem CID 164683846) has the molecular formula C25H39NSi and a molecular weight of 381.68 g/mol. Its IUPAC name is N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine.

Molecular Properties

Compound NameN-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine
PubChem CID164683846
Molecular FormulaC25H39NSi
Molecular Weight381.68 g/mol
Exact Mass381.29
IUPAC NameN-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine
SMILESCC[Si](CC)(CC)C(CCCCc1ccccc1)N(C)Cc1ccccc1
InChIInChI=1S/C25H39NSi/c1-5-27(6-2,7-3)25(26(4)22-24-19-12-9-13-20-24)21-15-14-18-23-16-10-8-11-17-23/h8-13,16-17,19-20,25H,5-7,14-15,18,21-22H2,1-4H3
InChIKeyHWZLPDXLQHLZAX-UHFFFAOYSA-N
XLogP6.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.68
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-N-methylheptan-2-amine
CID 101048002
5-methylheptylbenzene
CID 564254
N,N-dimethyl-5-phenylpentan-2-amine
CID 12951765
N-benzyl-N-methylbutan-2-amine
CID 15496809
4-phenylbutylbenzene
CID 141301927
(2S)-2-[benzyl(methyl)amino]hexanoic acid
CID 165358312
(1S)-N-benzyl-N-methyl-1-phenylethanamine
CID 122522292
N-benzyl-N-methyl-1-phenylpropan-2-amine
CID 2341
1-N'-benzyl-1-N,1-N'-dimethylheptadecane-1,1-diamine
CID 90352630
2-[benzyl(methyl)amino]-4-phenylbutanenitrile
CID 11161390
N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine
CID 14831238
hafnium;4-phenylbutylbenzene
CID 175889972

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine?
The IUPAC name of N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine (CID 164683846) is N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine.
What is the SMILES notation for N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine?
The canonical SMILES for N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine is CC[Si](CC)(CC)C(CCCCc1ccccc1)N(C)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine?
The InChIKey is HWZLPDXLQHLZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H39NSi/c1-5-27(6-2,7-3)25(26(4)22-24-19-12-9-13-20-24)21-15-14-18-23-16-10-8-11-17-23/h8-13,16-17,19-20,25H,5-7,14-15,18,21-22H2,1-4H3.
What are the key properties of N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine?
N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine has a molecular weight of 381.68 g/mol, XLogP of 6.95, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-5-phenyl-1-triethylsilylpentan-1-amine is sourced from PubChem (CID 164683846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).