4-propylsilylbutan-2-amine

C7H19NSi — CID 174914142

IUPAC4-propylsilylbutan-2-amine
SMILESCCC[SiH2]CCC(C)N
InChIInChI=1S/C7H19NSi/c1-3-5-9-6-4-7(2)8/h7H,3-6,8-9H2,1-2H3
InChIKeySTQMNQJBORMKPB-UHFFFAOYSA-N
MW145.32 g/mol
LogP1.14
Rot. Bonds5

About 4-propylsilylbutan-2-amine

4-propylsilylbutan-2-amine (PubChem CID 174914142) has the molecular formula C7H19NSi and a molecular weight of 145.32 g/mol. Its IUPAC name is 4-propylsilylbutan-2-amine.

Molecular Properties

Compound Name4-propylsilylbutan-2-amine
PubChem CID174914142
Molecular FormulaC7H19NSi
Molecular Weight145.32 g/mol
Exact Mass145.13
IUPAC Name4-propylsilylbutan-2-amine
SMILESCCC[SiH2]CCC(C)N
InChIInChI=1S/C7H19NSi/c1-3-5-9-6-4-7(2)8/h7H,3-6,8-9H2,1-2H3
InChIKeySTQMNQJBORMKPB-UHFFFAOYSA-N
XLogP1.14
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.32
LogP ≤ 51.14
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'}

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Related Compounds

(2S)-pentan-2-amine
CID 6997344
pentan-2-amine;propane
CID 166536368
dipropylsilane;hydrate
CID 174883766
ethane;molecular hydrogen;pentan-2-amine
CID 178004416
(5R)-hexane-2,5-diamine
CID 144618459
dodecan-2-amine;hydrochloride
CID 86195878
6-methylnonan-2-amine
CID 64502929
4-(2-methylpentylsulfanyl)butan-2-amine
CID 66232136
1-N'-propylsilylethane-1,1-diamine
CID 173131158
(2S)-nonadecan-2-amine
CID 94864909
(2S)-tridecan-2-amine
CID 24884182
(2S)-tetradecan-2-amine
CID 25021238

Frequently Asked Questions

What is the IUPAC name of 4-propylsilylbutan-2-amine?
The IUPAC name of 4-propylsilylbutan-2-amine (CID 174914142) is 4-propylsilylbutan-2-amine.
What is the SMILES notation for 4-propylsilylbutan-2-amine?
The canonical SMILES for 4-propylsilylbutan-2-amine is CCC[SiH2]CCC(C)N.
What is the InChIKey of 4-propylsilylbutan-2-amine?
The InChIKey is STQMNQJBORMKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19NSi/c1-3-5-9-6-4-7(2)8/h7H,3-6,8-9H2,1-2H3.
What are the key properties of 4-propylsilylbutan-2-amine?
4-propylsilylbutan-2-amine has a molecular weight of 145.32 g/mol, XLogP of 1.14, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propylsilylbutan-2-amine is sourced from PubChem (CID 174914142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).