(2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol

C10H10FN3O — CID 105459961

IUPAC(2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol
SMILESNc1ccc(F)cc1C(O)c1ccn[nH]1
InChIInChI=1S/C10H10FN3O/c11-6-1-2-8(12)7(5-6)10(15)9-3-4-13-14-9/h1-5,10,15H,12H2,(H,13,14)
InChIKeySRMYFEOHKBKLSJ-UHFFFAOYSA-N
MW207.21 g/mol
LogP1.21
Rot. Bonds2

About (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol

(2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol (PubChem CID 105459961) has the molecular formula C10H10FN3O and a molecular weight of 207.21 g/mol. Its IUPAC name is (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol.

Molecular Properties

Compound Name(2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol
PubChem CID105459961
Molecular FormulaC10H10FN3O
Molecular Weight207.21 g/mol
Exact Mass207.08
IUPAC Name(2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol
SMILESNc1ccc(F)cc1C(O)c1ccn[nH]1
InChIInChI=1S/C10H10FN3O/c11-6-1-2-8(12)7(5-6)10(15)9-3-4-13-14-9/h1-5,10,15H,12H2,(H,13,14)
InChIKeySRMYFEOHKBKLSJ-UHFFFAOYSA-N
XLogP1.21
TPSA74.93 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 51.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol?
The IUPAC name of (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol (CID 105459961) is (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol.
What is the SMILES notation for (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol?
The canonical SMILES for (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol is Nc1ccc(F)cc1C(O)c1ccn[nH]1.
What is the InChIKey of (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol?
The InChIKey is SRMYFEOHKBKLSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O/c11-6-1-2-8(12)7(5-6)10(15)9-3-4-13-14-9/h1-5,10,15H,12H2,(H,13,14).
What are the key properties of (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol?
(2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol has a molecular weight of 207.21 g/mol, XLogP of 1.21, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-5-fluorophenyl)-(1H-pyrazol-5-yl)methanol is sourced from PubChem (CID 105459961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).