[(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol

C13H16O — CID 11137881

IUPAC[(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol
SMILESOC[C@H]1C[C@H]1[C@H]1C[C@@H]1c1ccccc1
InChIInChI=1S/C13H16O/c14-8-10-6-11(10)13-7-12(13)9-4-2-1-3-5-9/h1-5,10-14H,6-8H2/t10-,11-,12-,13-/m1/s1
InChIKeySNNZUVSAKBFUAR-FDYHWXHSSA-N
MW188.27 g/mol
LogP2.42
Rot. Bonds3

About [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol

[(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol (PubChem CID 11137881) has the molecular formula C13H16O and a molecular weight of 188.27 g/mol. Its IUPAC name is [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol
PubChem CID11137881
Molecular FormulaC13H16O
Molecular Weight188.27 g/mol
Exact Mass188.12
IUPAC Name[(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol
SMILESOC[C@H]1C[C@H]1[C@H]1C[C@@H]1c1ccccc1
InChIInChI=1S/C13H16O/c14-8-10-6-11(10)13-7-12(13)9-4-2-1-3-5-9/h1-5,10-14H,6-8H2/t10-,11-,12-,13-/m1/s1
InChIKeySNNZUVSAKBFUAR-FDYHWXHSSA-N
XLogP2.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[(1S,2S)-2-phenylcyclobutyl]methanol
CID 99991987
ethane;[(1R,2R)-2-phenylcyclopropyl]methanol;zinc
CID 177478174
CID 102445902
CID 102445902
(2-phenyl-6-bicyclo[3.2.1]octanyl)methanol
CID 123628380
[(1R)-2-[(1R,2S)-2-ethenylcyclopropyl]cyclopropyl]benzene
CID 134846677
N-methyl-1-[2-(2-phenylcyclopropyl)cyclohexyl]methanamine
CID 116518650
2-[(3R,4S)-3-(hydroxymethyl)-4-phenylpyrrolidin-1-yl]ethanol
CID 129498083
6-phenyl-3-oxabicyclo[3.2.0]heptane
CID 73299099
N-[[4-ethyl-2-(2-phenylcyclopropyl)cyclohexyl]methyl]ethanamine
CID 116518670
[(1S,2R,5R)-2-amino-5-phenylcyclohexyl]methanol
CID 50989531
cis-(1R,2R)-2-phenylcyclopropan-1-amine;cis-(1S,2S)-2-phenylcyclopropan-1-amine;dihydrochloride
CID 76967138
2-(2-phenylcyclopropyl)-4-propylcyclohexan-1-amine
CID 116518607

Frequently Asked Questions

What is the IUPAC name of [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol?
The IUPAC name of [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol (CID 11137881) is [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol.
What is the SMILES notation for [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol?
The canonical SMILES for [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol is OC[C@H]1C[C@H]1[C@H]1C[C@@H]1c1ccccc1.
What is the InChIKey of [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol?
The InChIKey is SNNZUVSAKBFUAR-FDYHWXHSSA-N. The full InChI is InChI=1S/C13H16O/c14-8-10-6-11(10)13-7-12(13)9-4-2-1-3-5-9/h1-5,10-14H,6-8H2/t10-,11-,12-,13-/m1/s1.
What are the key properties of [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol?
[(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol has a molecular weight of 188.27 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2S)-2-[(1R,2S)-2-phenylcyclopropyl]cyclopropyl]methanol is sourced from PubChem (CID 11137881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).