N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine

C13H29NSi — CID 173154229

IUPACN-(3,7-dimethyloct-6-enylsilyl)propan-1-amine
SMILESCCCN[SiH2]CCC(C)CCC=C(C)C
InChIInChI=1S/C13H29NSi/c1-5-10-14-15-11-9-13(4)8-6-7-12(2)3/h7,13-14H,5-6,8-11,15H2,1-4H3
InChIKeyJZMJPRTULQNMQQ-UHFFFAOYSA-N
MW227.47 g/mol
LogP3.26
Rot. Bonds9

About N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine

N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine (PubChem CID 173154229) has the molecular formula C13H29NSi and a molecular weight of 227.47 g/mol. Its IUPAC name is N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine.

Molecular Properties

Compound NameN-(3,7-dimethyloct-6-enylsilyl)propan-1-amine
PubChem CID173154229
Molecular FormulaC13H29NSi
Molecular Weight227.47 g/mol
Exact Mass227.21
IUPAC NameN-(3,7-dimethyloct-6-enylsilyl)propan-1-amine
SMILESCCCN[SiH2]CCC(C)CCC=C(C)C
InChIInChI=1S/C13H29NSi/c1-5-10-14-15-11-9-13(4)8-6-7-12(2)3/h7,13-14H,5-6,8-11,15H2,1-4H3
InChIKeyJZMJPRTULQNMQQ-UHFFFAOYSA-N
XLogP3.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.47
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,7-dimethyldec-2-ene
CID 123304905
N,2,6-trimethylhept-5-en-1-amine
CID 146817482
(6S)-8-bromo-2,6-dimethyloct-2-ene
CID 10900106
CID 173125400
CID 173125400
(6S)-8-bromo-2,6-dimethyloct-2-ene;8-bromo-2,6-dimethyloct-2-ene
CID 131736485
5,9-dimethyldeca-1,8-diene
CID 12578605
2,6,10-trimethyltridec-2-en-7-ol
CID 88508201
2,6,10-trimethylundec-2-ene
CID 14805750
(2R)-2,6-dimethylhept-5-en-1-amine
CID 163211564
ethyl N-[(3S)-3,7-dimethyloct-6-enyl]carbamate
CID 125470360
2,6,10,13-tetramethyltetradec-2-ene
CID 58292520
(6S)-2,6-dimethyl-8-methylselanyloct-2-ene
CID 101158479

Frequently Asked Questions

What is the IUPAC name of N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine?
The IUPAC name of N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine (CID 173154229) is N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine.
What is the SMILES notation for N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine?
The canonical SMILES for N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine is CCCN[SiH2]CCC(C)CCC=C(C)C.
What is the InChIKey of N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine?
The InChIKey is JZMJPRTULQNMQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NSi/c1-5-10-14-15-11-9-13(4)8-6-7-12(2)3/h7,13-14H,5-6,8-11,15H2,1-4H3.
What are the key properties of N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine?
N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine has a molecular weight of 227.47 g/mol, XLogP of 3.26, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine is sourced from PubChem (CID 173154229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).