6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol

C15H13F3N2O — CID 105112544

IUPAC6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol
SMILESOC(c1ccc(C(F)(F)F)cn1)C1CCc2cccnc21
InChIInChI=1S/C15H13F3N2O/c16-15(17,18)10-4-6-12(20-8-10)14(21)11-5-3-9-2-1-7-19-13(9)11/h1-2,4,6-8,11,14,21H,3,5H2
InChIKeyMUGMIFQEOLBADK-UHFFFAOYSA-N
MW294.28 g/mol
LogP3.26
Rot. Bonds2

About 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol

6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol (PubChem CID 105112544) has the molecular formula C15H13F3N2O and a molecular weight of 294.28 g/mol. Its IUPAC name is 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol
PubChem CID105112544
Molecular FormulaC15H13F3N2O
Molecular Weight294.28 g/mol
Exact Mass294.10
IUPAC Name6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol
SMILESOC(c1ccc(C(F)(F)F)cn1)C1CCc2cccnc21
InChIInChI=1S/C15H13F3N2O/c16-15(17,18)10-4-6-12(20-8-10)14(21)11-5-3-9-2-1-7-19-13(9)11/h1-2,4,6-8,11,14,21H,3,5H2
InChIKeyMUGMIFQEOLBADK-UHFFFAOYSA-N
XLogP3.26
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.28
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol?
The IUPAC name of 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol (CID 105112544) is 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol.
What is the SMILES notation for 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol?
The canonical SMILES for 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol is OC(c1ccc(C(F)(F)F)cn1)C1CCc2cccnc21.
What is the InChIKey of 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol?
The InChIKey is MUGMIFQEOLBADK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O/c16-15(17,18)10-4-6-12(20-8-10)14(21)11-5-3-9-2-1-7-19-13(9)11/h1-2,4,6-8,11,14,21H,3,5H2.
What are the key properties of 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol?
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol has a molecular weight of 294.28 g/mol, XLogP of 3.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol is sourced from PubChem (CID 105112544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).