(1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol

C10H10O2 — CID 784916

IUPAC(1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol
SMILESO[C@H](C#CC1CC1)c1ccco1
InChIInChI=1S/C10H10O2/c11-9(6-5-8-3-4-8)10-2-1-7-12-10/h1-2,7-9,11H,3-4H2/t9-/m1/s1
InChIKeyMSZRWYGWFXUTSC-SECBINFHSA-N
MW162.19 g/mol
LogP1.73
Rot. Bonds1

About (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol

(1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol (PubChem CID 784916) has the molecular formula C10H10O2 and a molecular weight of 162.19 g/mol. Its IUPAC name is (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol.

Molecular Properties

Compound Name(1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol
PubChem CID784916
Molecular FormulaC10H10O2
Molecular Weight162.19 g/mol
Exact Mass162.07
IUPAC Name(1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol
SMILESO[C@H](C#CC1CC1)c1ccco1
InChIInChI=1S/C10H10O2/c11-9(6-5-8-3-4-8)10-2-1-7-12-10/h1-2,7-9,11H,3-4H2/t9-/m1/s1
InChIKeyMSZRWYGWFXUTSC-SECBINFHSA-N
XLogP1.73
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol?
The IUPAC name of (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol (CID 784916) is (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol.
What is the SMILES notation for (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol?
The canonical SMILES for (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol is O[C@H](C#CC1CC1)c1ccco1.
What is the InChIKey of (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol?
The InChIKey is MSZRWYGWFXUTSC-SECBINFHSA-N. The full InChI is InChI=1S/C10H10O2/c11-9(6-5-8-3-4-8)10-2-1-7-12-10/h1-2,7-9,11H,3-4H2/t9-/m1/s1.
What are the key properties of (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol?
(1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol has a molecular weight of 162.19 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-cyclopropyl-1-(furan-2-yl)prop-2-yn-1-ol is sourced from PubChem (CID 784916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).