[3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol

C10H11FN4O2 — CID 107690642

IUPAC[3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol
SMILESCn1nnc(COc2ccc(CO)cc2F)n1
InChIInChI=1S/C10H11FN4O2/c1-15-13-10(12-14-15)6-17-9-3-2-7(5-16)4-8(9)11/h2-4,16H,5-6H2,1H3
InChIKeyDOILOBOVFPRVHF-UHFFFAOYSA-N
MW238.22 g/mol
LogP0.42
Rot. Bonds4

About [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol

[3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol (PubChem CID 107690642) has the molecular formula C10H11FN4O2 and a molecular weight of 238.22 g/mol. Its IUPAC name is [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol
PubChem CID107690642
Molecular FormulaC10H11FN4O2
Molecular Weight238.22 g/mol
Exact Mass238.09
IUPAC Name[3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol
SMILESCn1nnc(COc2ccc(CO)cc2F)n1
InChIInChI=1S/C10H11FN4O2/c1-15-13-10(12-14-15)6-17-9-3-2-7(5-16)4-8(9)11/h2-4,16H,5-6H2,1H3
InChIKeyDOILOBOVFPRVHF-UHFFFAOYSA-N
XLogP0.42
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.22
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol?
The IUPAC name of [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol (CID 107690642) is [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol.
What is the SMILES notation for [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol?
The canonical SMILES for [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol is Cn1nnc(COc2ccc(CO)cc2F)n1.
What is the InChIKey of [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol?
The InChIKey is DOILOBOVFPRVHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN4O2/c1-15-13-10(12-14-15)6-17-9-3-2-7(5-16)4-8(9)11/h2-4,16H,5-6H2,1H3.
What are the key properties of [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol?
[3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol has a molecular weight of 238.22 g/mol, XLogP of 0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanol is sourced from PubChem (CID 107690642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).