(1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine

C17H37NOSi — CID 15315174

IUPAC(1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
SMILESCC(C)[Si](OCCC1C[C@]1(C)N(C)C)(C(C)C)C(C)C
InChIInChI=1S/C17H37NOSi/c1-13(2)20(14(3)4,15(5)6)19-11-10-16-12-17(16,7)18(8)9/h13-16H,10-12H2,1-9H3/t16?,17-/m0/s1
InChIKeyIOUDHSRMDYDPSO-DJNXLDHESA-N
MW299.58 g/mol
LogP4.91
Rot. Bonds8

About (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine

(1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine (PubChem CID 15315174) has the molecular formula C17H37NOSi and a molecular weight of 299.58 g/mol. Its IUPAC name is (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name(1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
PubChem CID15315174
Molecular FormulaC17H37NOSi
Molecular Weight299.58 g/mol
Exact Mass299.26
IUPAC Name(1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
SMILESCC(C)[Si](OCCC1C[C@]1(C)N(C)C)(C(C)C)C(C)C
InChIInChI=1S/C17H37NOSi/c1-13(2)20(14(3)4,15(5)6)19-11-10-16-12-17(16,7)18(8)9/h13-16H,10-12H2,1-9H3/t16?,17-/m0/s1
InChIKeyIOUDHSRMDYDPSO-DJNXLDHESA-N
XLogP4.91
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.58
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
The IUPAC name of (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine (CID 15315174) is (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine.
What is the SMILES notation for (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
The canonical SMILES for (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine is CC(C)[Si](OCCC1C[C@]1(C)N(C)C)(C(C)C)C(C)C.
What is the InChIKey of (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
The InChIKey is IOUDHSRMDYDPSO-DJNXLDHESA-N. The full InChI is InChI=1S/C17H37NOSi/c1-13(2)20(14(3)4,15(5)6)19-11-10-16-12-17(16,7)18(8)9/h13-16H,10-12H2,1-9H3/t16?,17-/m0/s1.
What are the key properties of (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
(1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine has a molecular weight of 299.58 g/mol, XLogP of 4.91, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine is sourced from PubChem (CID 15315174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).