(1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol

C14H18O — CID 12724899

IUPAC(1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol
SMILESC=C[C@H]1C[C@H]1[C@H](O)CCc1ccccc1
InChIInChI=1S/C14H18O/c1-2-12-10-13(12)14(15)9-8-11-6-4-3-5-7-11/h2-7,12-15H,1,8-10H2/t12-,13+,14+/m0/s1
InChIKeyQNLSWYQFGWUWDT-BFHYXJOUSA-N
MW202.30 g/mol
LogP2.80
Rot. Bonds5

About (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol

(1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol (PubChem CID 12724899) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol.

Molecular Properties

Compound Name(1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol
PubChem CID12724899
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name(1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol
SMILESC=C[C@H]1C[C@H]1[C@H](O)CCc1ccccc1
InChIInChI=1S/C14H18O/c1-2-12-10-13(12)14(15)9-8-11-6-4-3-5-7-11/h2-7,12-15H,1,8-10H2/t12-,13+,14+/m0/s1
InChIKeyQNLSWYQFGWUWDT-BFHYXJOUSA-N
XLogP2.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(1R)-1-cyclopentyl-3-phenylpropan-1-ol
CID 15361902
(3S)-4-methyl-1-phenylhex-5-en-3-ol
CID 177392866
(4S)-4-methyl-1-phenylhex-5-en-3-ol
CID 12938739
3-cyclohexyl-6-phenylhex-1-ene-3,4-diol
CID 85416610
1,5-diphenylpentan-3-ol;hydrochloride
CID 139805992
(3R,4R)-1,6-diphenylhexane-3,4-diol;dihydrochloride
CID 67941860
[(3R)-3-bromohex-5-enyl]benzene
CID 125475823
(3R)-4,4-difluoro-1-phenylhex-5-en-3-ol
CID 102308052
(3S)-4,4-difluoro-1-phenylhex-5-en-3-ol
CID 102308053
(3R)-3-(2-phenylethyl)-N,N-di(propan-2-yl)pent-4-enamide
CID 162405396
trans-(2S,3S)-3-hydroxy-2-[(1S)-1-hydroxy-3-phenylpropyl]cyclopentan-1-one
CID 101184919
1-(1,4-dithian-2-yl)-3-phenylpropan-1-ol
CID 79972288

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol?
The IUPAC name of (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol (CID 12724899) is (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol.
What is the SMILES notation for (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol?
The canonical SMILES for (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol is C=C[C@H]1C[C@H]1[C@H](O)CCc1ccccc1.
What is the InChIKey of (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol?
The InChIKey is QNLSWYQFGWUWDT-BFHYXJOUSA-N. The full InChI is InChI=1S/C14H18O/c1-2-12-10-13(12)14(15)9-8-11-6-4-3-5-7-11/h2-7,12-15H,1,8-10H2/t12-,13+,14+/m0/s1.
What are the key properties of (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol?
(1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol has a molecular weight of 202.30 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[(1R,2R)-2-ethenylcyclopropyl]-3-phenylpropan-1-ol is sourced from PubChem (CID 12724899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).