cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol

C9H20OSi — CID 134997612

IUPACcis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol
SMILESCCC[C@@]1(O)C[C@@H]1[Si](C)(C)C
InChIInChI=1S/C9H20OSi/c1-5-6-9(10)7-8(9)11(2,3)4/h8,10H,5-7H2,1-4H3/t8-,9+/m0/s1
InChIKeyNXWCAMMJZLMBEH-DTWKUNHWSA-N
MW172.34 g/mol
LogP2.63
Rot. Bonds3

About cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol

cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol (PubChem CID 134997612) has the molecular formula C9H20OSi and a molecular weight of 172.34 g/mol. Its IUPAC name is cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol.

Molecular Properties

Compound Namecis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol
PubChem CID134997612
Molecular FormulaC9H20OSi
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Namecis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol
SMILESCCC[C@@]1(O)C[C@@H]1[Si](C)(C)C
InChIInChI=1S/C9H20OSi/c1-5-6-9(10)7-8(9)11(2,3)4/h8,10H,5-7H2,1-4H3/t8-,9+/m0/s1
InChIKeyNXWCAMMJZLMBEH-DTWKUNHWSA-N
XLogP2.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 52.63
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

trans-(1R,2R)-1-[2-(furan-2-yl)ethyl]-2-trimethylsilylcyclopropan-1-ol
CID 10751640
2,4-dimethyl-1-propylcyclohexan-1-ol
CID 64756023
2-[butyl(dimethyl)silyl]-1-methylcyclopropan-1-ol
CID 68626631
trans-(1S,2R)-1,2-dipropylcyclopentan-1-ol
CID 135054569
cis-(1S,2S)-1,2-dihexylcyclopropan-1-ol
CID 14921306
1-propylcyclodecane-1,2-diol
CID 173377333
8-propyltricyclo[5.2.1.02,6]decan-8-ol
CID 13386823
(2,2-dichlorocyclopropyl)-trimethylsilane
CID 12700404
4-ethyl-4-propylcyclohexan-1-ol
CID 91476830
2-[hexyl(dimethyl)silyl]-1-methylcyclopropan-1-ol
CID 68625690
3-methyl-3-propylcyclobutan-1-ol
CID 176695385
(3R,4R)-4-(hydroxymethyl)-2-methyl-2-propyloxolane-3,4-diol
CID 154968315

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol?
The IUPAC name of cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol (CID 134997612) is cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol.
What is the SMILES notation for cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol?
The canonical SMILES for cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol is CCC[C@@]1(O)C[C@@H]1[Si](C)(C)C.
What is the InChIKey of cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol?
The InChIKey is NXWCAMMJZLMBEH-DTWKUNHWSA-N. The full InChI is InChI=1S/C9H20OSi/c1-5-6-9(10)7-8(9)11(2,3)4/h8,10H,5-7H2,1-4H3/t8-,9+/m0/s1.
What are the key properties of cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol?
cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol has a molecular weight of 172.34 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol is sourced from PubChem (CID 134997612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).