1-dimethoxysilyl-5-phenylpentan-2-amine

C13H23NO2Si — CID 174935526

IUPAC1-dimethoxysilyl-5-phenylpentan-2-amine
SMILESCO[SiH](CC(N)CCCc1ccccc1)OC
InChIInChI=1S/C13H23NO2Si/c1-15-17(16-2)11-13(14)10-6-9-12-7-4-3-5-8-12/h3-5,7-8,13,17H,6,9-11,14H2,1-2H3
InChIKeyCVQOJQBPKJDHTN-UHFFFAOYSA-N
MW253.42 g/mol
LogP1.85
Rot. Bonds8

About 1-dimethoxysilyl-5-phenylpentan-2-amine

1-dimethoxysilyl-5-phenylpentan-2-amine (PubChem CID 174935526) has the molecular formula C13H23NO2Si and a molecular weight of 253.42 g/mol. Its IUPAC name is 1-dimethoxysilyl-5-phenylpentan-2-amine.

Molecular Properties

Compound Name1-dimethoxysilyl-5-phenylpentan-2-amine
PubChem CID174935526
Molecular FormulaC13H23NO2Si
Molecular Weight253.42 g/mol
Exact Mass253.15
IUPAC Name1-dimethoxysilyl-5-phenylpentan-2-amine
SMILESCO[SiH](CC(N)CCCc1ccccc1)OC
InChIInChI=1S/C13H23NO2Si/c1-15-17(16-2)11-13(14)10-6-9-12-7-4-3-5-8-12/h3-5,7-8,13,17H,6,9-11,14H2,1-2H3
InChIKeyCVQOJQBPKJDHTN-UHFFFAOYSA-N
XLogP1.85
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.42
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-phenyloctan-4-amine
CID 79413314
7-phenylheptane-1,4-diamine
CID 174860311
(2S)-2-amino-5-phenylpentane-1-thiol
CID 87877101
(2R)-2-amino-5-phenylpentan-1-ol
CID 20677771
1-(3-fluoro-4-methoxyphenyl)-5-phenylpentan-2-amine
CID 105122085
2-methoxy-2-methyl-6-phenylhexan-3-amine
CID 79197663
1-(3,4-dimethoxyphenyl)-4-phenylbutan-1-amine
CID 62606434
methyl (2R)-2-amino-5-phenylpentanoate;hydrochloride
CID 137346959
(4-chloro-4-methoxybutyl)benzene
CID 15657447
1-(6-methoxypyridazin-3-yl)-4-phenylbutan-1-amine
CID 103373753
5-phenyl-1-phenylsulfanylpentan-2-amine
CID 65141833
1-methoxy-4-(6-phenylhexyl)benzene
CID 54077830

Frequently Asked Questions

What is the IUPAC name of 1-dimethoxysilyl-5-phenylpentan-2-amine?
The IUPAC name of 1-dimethoxysilyl-5-phenylpentan-2-amine (CID 174935526) is 1-dimethoxysilyl-5-phenylpentan-2-amine.
What is the SMILES notation for 1-dimethoxysilyl-5-phenylpentan-2-amine?
The canonical SMILES for 1-dimethoxysilyl-5-phenylpentan-2-amine is CO[SiH](CC(N)CCCc1ccccc1)OC.
What is the InChIKey of 1-dimethoxysilyl-5-phenylpentan-2-amine?
The InChIKey is CVQOJQBPKJDHTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2Si/c1-15-17(16-2)11-13(14)10-6-9-12-7-4-3-5-8-12/h3-5,7-8,13,17H,6,9-11,14H2,1-2H3.
What are the key properties of 1-dimethoxysilyl-5-phenylpentan-2-amine?
1-dimethoxysilyl-5-phenylpentan-2-amine has a molecular weight of 253.42 g/mol, XLogP of 1.85, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dimethoxysilyl-5-phenylpentan-2-amine is sourced from PubChem (CID 174935526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).