1-chloro-N-ethyl-1-propan-2-ylsilylethanamine

C7H18ClNSi — CID 173059485

IUPAC1-chloro-N-ethyl-1-propan-2-ylsilylethanamine
SMILESCCNC(C)(Cl)[SiH2]C(C)C
InChIInChI=1S/C7H18ClNSi/c1-5-9-7(4,8)10-6(2)3/h6,9H,5,10H2,1-4H3
InChIKeyUOBMFAUKLOXYBX-UHFFFAOYSA-N
MW179.77 g/mol
LogP1.51
Rot. Bonds4

About 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine

1-chloro-N-ethyl-1-propan-2-ylsilylethanamine (PubChem CID 173059485) has the molecular formula C7H18ClNSi and a molecular weight of 179.77 g/mol. Its IUPAC name is 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine.

Molecular Properties

Compound Name1-chloro-N-ethyl-1-propan-2-ylsilylethanamine
PubChem CID173059485
Molecular FormulaC7H18ClNSi
Molecular Weight179.77 g/mol
Exact Mass179.09
IUPAC Name1-chloro-N-ethyl-1-propan-2-ylsilylethanamine
SMILESCCNC(C)(Cl)[SiH2]C(C)C
InChIInChI=1S/C7H18ClNSi/c1-5-9-7(4,8)10-6(2)3/h6,9H,5,10H2,1-4H3
InChIKeyUOBMFAUKLOXYBX-UHFFFAOYSA-N
XLogP1.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.77
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-3-methoxy-2-methylbutan-2-amine
CID 118495888
1-chloro-1-N,1-N'-diethylpropane-1,1-diamine;hydrochloride
CID 161482790
1-N,1-N'-dimethyl-1-propan-2-ylsilylethane-1,1-diamine
CID 173059311
1-tert-butylsilyl-N,N'-diethylmethanediamine
CID 123959380
2,2-dichloro-2-(ethylamino)acetaldehyde
CID 130010789
N-ethyl-2,4,4,5,5,6-hexamethylheptan-2-amine
CID 129309764
1-chloro-1-N-ethyl-1-N',1-N',2-trimethyl-2-silylpropane-1,1-diamine
CID 173059198
2-N'-butan-2-yl-2-N-ethyl-2-N'-methylbutane-2,2-diamine
CID 173142647
N-ethyl-2-methyl-3-silylpentan-3-amine
CID 173064739
2-(ethylamino)-3-methyl-2-propan-2-ylbutan-1-ol
CID 174847311
2-(ethylamino)-3-methyl-2-propan-2-ylbutanenitrile
CID 141254263
1,2-dichloro-N-propan-2-ylpropan-2-amine;phosphane
CID 160903249

Frequently Asked Questions

What is the IUPAC name of 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine?
The IUPAC name of 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine (CID 173059485) is 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine.
What is the SMILES notation for 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine?
The canonical SMILES for 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine is CCNC(C)(Cl)[SiH2]C(C)C.
What is the InChIKey of 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine?
The InChIKey is UOBMFAUKLOXYBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18ClNSi/c1-5-9-7(4,8)10-6(2)3/h6,9H,5,10H2,1-4H3.
What are the key properties of 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine?
1-chloro-N-ethyl-1-propan-2-ylsilylethanamine has a molecular weight of 179.77 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-N-ethyl-1-propan-2-ylsilylethanamine is sourced from PubChem (CID 173059485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).