2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol

C14H20O — CID 83148065

IUPAC2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol
SMILESCCc1ccc(C(O)C(C)C2CC2)cc1
InChIInChI=1S/C14H20O/c1-3-11-4-6-13(7-5-11)14(15)10(2)12-8-9-12/h4-7,10,12,14-15H,3,8-9H2,1-2H3
InChIKeyAYLMUHVMTYTMOC-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.33
Rot. Bonds4

About 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol

2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol (PubChem CID 83148065) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol
PubChem CID83148065
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol
SMILESCCc1ccc(C(O)C(C)C2CC2)cc1
InChIInChI=1S/C14H20O/c1-3-11-4-6-13(7-5-11)14(15)10(2)12-8-9-12/h4-7,10,12,14-15H,3,8-9H2,1-2H3
InChIKeyAYLMUHVMTYTMOC-UHFFFAOYSA-N
XLogP3.33
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol?
The IUPAC name of 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol (CID 83148065) is 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol is CCc1ccc(C(O)C(C)C2CC2)cc1.
What is the InChIKey of 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol?
The InChIKey is AYLMUHVMTYTMOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-3-11-4-6-13(7-5-11)14(15)10(2)12-8-9-12/h4-7,10,12,14-15H,3,8-9H2,1-2H3.
What are the key properties of 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol?
2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol has a molecular weight of 204.31 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(4-ethylphenyl)propan-1-ol is sourced from PubChem (CID 83148065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).