N-butan-2-yl-3-silylbut-2-en-2-amine

C8H19NSi — CID 174047841

IUPACN-butan-2-yl-3-silylbut-2-en-2-amine
SMILESCCC(C)NC(C)=C(C)[SiH3]
InChIInChI=1S/C8H19NSi/c1-5-6(2)9-7(3)8(4)10/h6,9H,5H2,1-4,10H3
InChIKeyORAGNGHKIRRDHU-UHFFFAOYSA-N
MW157.33 g/mol
LogP0.99
Rot. Bonds3

About N-butan-2-yl-3-silylbut-2-en-2-amine

N-butan-2-yl-3-silylbut-2-en-2-amine (PubChem CID 174047841) has the molecular formula C8H19NSi and a molecular weight of 157.33 g/mol. Its IUPAC name is N-butan-2-yl-3-silylbut-2-en-2-amine.

Molecular Properties

Compound NameN-butan-2-yl-3-silylbut-2-en-2-amine
PubChem CID174047841
Molecular FormulaC8H19NSi
Molecular Weight157.33 g/mol
Exact Mass157.13
IUPAC NameN-butan-2-yl-3-silylbut-2-en-2-amine
SMILESCCC(C)NC(C)=C(C)[SiH3]
InChIInChI=1S/C8H19NSi/c1-5-6(2)9-7(3)8(4)10/h6,9H,5H2,1-4,10H3
InChIKeyORAGNGHKIRRDHU-UHFFFAOYSA-N
XLogP0.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.33
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,3-di(butan-2-yl)thiourea
CID 5366322
N-butan-2-ylcarbamoyl iodide
CID 118554163
N-[(2R)-butan-2-yl]-2-methylbutanamide
CID 88542995
N-butan-2-yl-4-oxopentanamide
CID 60635035
3-amino-N-[(2S)-butan-2-yl]butanamide
CID 142118681
1-butan-2-yl-3-methylthiourea
CID 12906295
N'-[(2R)-butan-2-yl]oxamide
CID 124605597
CID 162685226
CID 162685226
N-[(2R)-butan-2-yl]-2,3,4,5,6-pentamethylbenzamide
CID 95358520
N-(2-methylprop-1-enylsilyl)butan-2-amine
CID 172825506
(2R)-N-[(2S)-butan-2-yl]-2-chloropropanamide
CID 14711535
1-butan-2-yl-3-ethylthiourea
CID 19652064

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3-silylbut-2-en-2-amine?
The IUPAC name of N-butan-2-yl-3-silylbut-2-en-2-amine (CID 174047841) is N-butan-2-yl-3-silylbut-2-en-2-amine.
What is the SMILES notation for N-butan-2-yl-3-silylbut-2-en-2-amine?
The canonical SMILES for N-butan-2-yl-3-silylbut-2-en-2-amine is CCC(C)NC(C)=C(C)[SiH3].
What is the InChIKey of N-butan-2-yl-3-silylbut-2-en-2-amine?
The InChIKey is ORAGNGHKIRRDHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NSi/c1-5-6(2)9-7(3)8(4)10/h6,9H,5H2,1-4,10H3.
What are the key properties of N-butan-2-yl-3-silylbut-2-en-2-amine?
N-butan-2-yl-3-silylbut-2-en-2-amine has a molecular weight of 157.33 g/mol, XLogP of 0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-3-silylbut-2-en-2-amine is sourced from PubChem (CID 174047841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).