[4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride

C8H11ClFNO — CID 71757349

IUPAC[4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride
SMILESCl.NCc1ccc(CO)c(F)c1
InChIInChI=1S/C8H10FNO.ClH/c9-8-3-6(4-10)1-2-7(8)5-11;/h1-3,11H,4-5,10H2;1H
InChIKeyBRWGDIJWDVEJKM-UHFFFAOYSA-N
MW191.63 g/mol
LogP1.20
Rot. Bonds2

About [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride

[4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride (PubChem CID 71757349) has the molecular formula C8H11ClFNO and a molecular weight of 191.63 g/mol. Its IUPAC name is [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride.

Molecular Properties

Compound Name[4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride
PubChem CID71757349
Molecular FormulaC8H11ClFNO
Molecular Weight191.63 g/mol
Exact Mass191.05
IUPAC Name[4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride
SMILESCl.NCc1ccc(CO)c(F)c1
InChIInChI=1S/C8H10FNO.ClH/c9-8-3-6(4-10)1-2-7(8)5-11;/h1-3,11H,4-5,10H2;1H
InChIKeyBRWGDIJWDVEJKM-UHFFFAOYSA-N
XLogP1.20
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.63
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride?
The IUPAC name of [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride (CID 71757349) is [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride.
What is the SMILES notation for [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride?
The canonical SMILES for [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride is Cl.NCc1ccc(CO)c(F)c1.
What is the InChIKey of [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride?
The InChIKey is BRWGDIJWDVEJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO.ClH/c9-8-3-6(4-10)1-2-7(8)5-11;/h1-3,11H,4-5,10H2;1H.
What are the key properties of [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride?
[4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride has a molecular weight of 191.63 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(aminomethyl)-2-fluorophenyl]methanol;hydrochloride is sourced from PubChem (CID 71757349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).