[4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol

C8H8F4N2O2 — CID 118811822

IUPAC[4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol
SMILESNc1cc(CF)nc(CO)c1OC(F)(F)F
InChIInChI=1S/C8H8F4N2O2/c9-2-4-1-5(13)7(6(3-15)14-4)16-8(10,11)12/h1,15H,2-3H2,(H2,13,14)
InChIKeyRWDGCWQQYVGPDS-UHFFFAOYSA-N
MW240.16 g/mol
LogP1.52
Rot. Bonds3

About [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol

[4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol (PubChem CID 118811822) has the molecular formula C8H8F4N2O2 and a molecular weight of 240.16 g/mol. Its IUPAC name is [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol
PubChem CID118811822
Molecular FormulaC8H8F4N2O2
Molecular Weight240.16 g/mol
Exact Mass240.05
IUPAC Name[4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol
SMILESNc1cc(CF)nc(CO)c1OC(F)(F)F
InChIInChI=1S/C8H8F4N2O2/c9-2-4-1-5(13)7(6(3-15)14-4)16-8(10,11)12/h1,15H,2-3H2,(H2,13,14)
InChIKeyRWDGCWQQYVGPDS-UHFFFAOYSA-N
XLogP1.52
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.16
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[6-(aminomethyl)-3-methoxy-4-(trifluoromethoxy)-2-pyridinyl]methanol
CID 134666113
2-(aminomethyl)-6-methoxy-3-(trifluoromethoxy)pyridin-4-amine
CID 118824129
[2-amino-6-(aminomethyl)-3-(trifluoromethoxy)-4-pyridinyl]methanol
CID 133085817
[4-(aminomethyl)-6-methoxy-3-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118812946
2-(aminomethyl)-6-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine
CID 118823621
[3-amino-5-fluoro-2-(trifluoromethoxy)phenyl]methanol
CID 131261840
[4-amino-2-(aminomethyl)-6-(trifluoromethoxy)-3-pyridinyl]methanol
CID 118850873
[6-bromo-3-(trifluoromethoxy)-4-(trifluoromethyl)-2-pyridinyl]methanol
CID 133087725
2-[4-amino-6-chloro-3-(trifluoromethoxy)-2-pyridinyl]acetic acid
CID 118811812
[4-methoxy-3-(trifluoromethoxy)-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 134668178
[4-(aminomethyl)-3-methyl-6-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118807357
[5-fluoro-2-(fluoromethyl)-4-(trifluoromethoxy)-3-pyridinyl]methanol
CID 134680899

Frequently Asked Questions

What is the IUPAC name of [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol?
The IUPAC name of [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol (CID 118811822) is [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol.
What is the SMILES notation for [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol?
The canonical SMILES for [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol is Nc1cc(CF)nc(CO)c1OC(F)(F)F.
What is the InChIKey of [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol?
The InChIKey is RWDGCWQQYVGPDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F4N2O2/c9-2-4-1-5(13)7(6(3-15)14-4)16-8(10,11)12/h1,15H,2-3H2,(H2,13,14).
What are the key properties of [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol?
[4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol has a molecular weight of 240.16 g/mol, XLogP of 1.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-amino-6-(fluoromethyl)-3-(trifluoromethoxy)-2-pyridinyl]methanol is sourced from PubChem (CID 118811822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).