2-(6-cyclopropyl-3-pyridinyl)phenol

C14H13NO — CID 138566392

IUPAC2-(6-cyclopropyl-3-pyridinyl)phenol
SMILESOc1ccccc1-c1ccc(C2CC2)nc1
InChIInChI=1S/C14H13NO/c16-14-4-2-1-3-12(14)11-7-8-13(15-9-11)10-5-6-10/h1-4,7-10,16H,5-6H2
InChIKeyTYMFATRPNZTPAW-UHFFFAOYSA-N
MW211.26 g/mol
LogP3.33
Rot. Bonds2

About 2-(6-cyclopropyl-3-pyridinyl)phenol

2-(6-cyclopropyl-3-pyridinyl)phenol (PubChem CID 138566392) has the molecular formula C14H13NO and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-(6-cyclopropyl-3-pyridinyl)phenol.

Molecular Properties

Compound Name2-(6-cyclopropyl-3-pyridinyl)phenol
PubChem CID138566392
Molecular FormulaC14H13NO
Molecular Weight211.26 g/mol
Exact Mass211.10
IUPAC Name2-(6-cyclopropyl-3-pyridinyl)phenol
SMILESOc1ccccc1-c1ccc(C2CC2)nc1
InChIInChI=1S/C14H13NO/c16-14-4-2-1-3-12(14)11-7-8-13(15-9-11)10-5-6-10/h1-4,7-10,16H,5-6H2
InChIKeyTYMFATRPNZTPAW-UHFFFAOYSA-N
XLogP3.33
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-cyclopropyl-3-pyridinyl)phenol?
The IUPAC name of 2-(6-cyclopropyl-3-pyridinyl)phenol (CID 138566392) is 2-(6-cyclopropyl-3-pyridinyl)phenol.
What is the SMILES notation for 2-(6-cyclopropyl-3-pyridinyl)phenol?
The canonical SMILES for 2-(6-cyclopropyl-3-pyridinyl)phenol is Oc1ccccc1-c1ccc(C2CC2)nc1.
What is the InChIKey of 2-(6-cyclopropyl-3-pyridinyl)phenol?
The InChIKey is TYMFATRPNZTPAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO/c16-14-4-2-1-3-12(14)11-7-8-13(15-9-11)10-5-6-10/h1-4,7-10,16H,5-6H2.
What are the key properties of 2-(6-cyclopropyl-3-pyridinyl)phenol?
2-(6-cyclopropyl-3-pyridinyl)phenol has a molecular weight of 211.26 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-cyclopropyl-3-pyridinyl)phenol is sourced from PubChem (CID 138566392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).