[4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol

C14H19NO3 — CID 21221206

IUPAC[4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol
SMILESCOc1cnc(CO)cc1OC1CC2CCC1C2
InChIInChI=1S/C14H19NO3/c1-17-14-7-15-11(8-16)6-13(14)18-12-5-9-2-3-10(12)4-9/h6-7,9-10,12,16H,2-5,8H2,1H3
InChIKeyLZFPJZPFQFJCTP-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.15
Rot. Bonds4

About [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol

[4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol (PubChem CID 21221206) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol
PubChem CID21221206
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC Name[4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol
SMILESCOc1cnc(CO)cc1OC1CC2CCC1C2
InChIInChI=1S/C14H19NO3/c1-17-14-7-15-11(8-16)6-13(14)18-12-5-9-2-3-10(12)4-9/h6-7,9-10,12,16H,2-5,8H2,1H3
InChIKeyLZFPJZPFQFJCTP-UHFFFAOYSA-N
XLogP2.15
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol?
The IUPAC name of [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol (CID 21221206) is [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol.
What is the SMILES notation for [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol?
The canonical SMILES for [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol is COc1cnc(CO)cc1OC1CC2CCC1C2.
What is the InChIKey of [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol?
The InChIKey is LZFPJZPFQFJCTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-17-14-7-15-11(8-16)6-13(14)18-12-5-9-2-3-10(12)4-9/h6-7,9-10,12,16H,2-5,8H2,1H3.
What are the key properties of [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol?
[4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol has a molecular weight of 249.31 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-bicyclo[2.2.1]heptanyloxy)-5-methoxy-2-pyridinyl]methanol is sourced from PubChem (CID 21221206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).