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

C16H35NOSi — CID 10779525

IUPACcis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
SMILESCC(C)[Si](OCC[C@H]1C[C@@H]1N(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H35NOSi/c1-12(2)19(13(3)4,14(5)6)18-10-9-15-11-16(15)17(7)8/h12-16H,9-11H2,1-8H3/t15-,16-/m0/s1
InChIKeyPJDUGXJJIWDPPM-HOTGVXAUSA-N
MW285.55 g/mol
LogP4.52
Rot. Bonds8

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

cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine (PubChem CID 10779525) has the molecular formula C16H35NOSi and a molecular weight of 285.55 g/mol. Its IUPAC name is cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine.

Molecular Properties

Compound Namecis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
PubChem CID10779525
Molecular FormulaC16H35NOSi
Molecular Weight285.55 g/mol
Exact Mass285.25
IUPAC Namecis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
SMILESCC(C)[Si](OCC[C@H]1C[C@@H]1N(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H35NOSi/c1-12(2)19(13(3)4,14(5)6)18-10-9-15-11-16(15)17(7)8/h12-16H,9-11H2,1-8H3/t15-,16-/m0/s1
InChIKeyPJDUGXJJIWDPPM-HOTGVXAUSA-N
XLogP4.52
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.55
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 15315174
(1S)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 15321158
(1S)-N,N-diethyl-1-methyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 134905899
(1S)-N,N-diethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 134905975
trans-(1R,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 146018994
cis-(1R,2S)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 146018995
cis-(1S,2S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 10614124
N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 10709301
N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 10850734
(2S)-N,N,1-trimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 15315175
(2S)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine
CID 102094233

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
The IUPAC name of cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine (CID 10779525) is cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine.
What is the SMILES notation for cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
The canonical SMILES for cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine is CC(C)[Si](OCC[C@H]1C[C@@H]1N(C)C)(C(C)C)C(C)C.
What is the InChIKey of cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
The InChIKey is PJDUGXJJIWDPPM-HOTGVXAUSA-N. The full InChI is InChI=1S/C16H35NOSi/c1-12(2)19(13(3)4,14(5)6)18-10-9-15-11-16(15)17(7)8/h12-16H,9-11H2,1-8H3/t15-,16-/m0/s1.
What are the key properties of cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine?
cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine has a molecular weight of 285.55 g/mol, XLogP of 4.52, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-N,N-dimethyl-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-amine is sourced from PubChem (CID 10779525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).