2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol

C10H12FN3O — CID 84780514

IUPAC2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol
SMILESCn1c(C(N)CO)cc2ncc(F)cc21
InChIInChI=1S/C10H12FN3O/c1-14-9(7(12)5-15)3-8-10(14)2-6(11)4-13-8/h2-4,7,15H,5,12H2,1H3
InChIKeyACCXGUUDHYCNFA-UHFFFAOYSA-N
MW209.22 g/mol
LogP0.70
Rot. Bonds2

About 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol

2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol (PubChem CID 84780514) has the molecular formula C10H12FN3O and a molecular weight of 209.22 g/mol. Its IUPAC name is 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol
PubChem CID84780514
Molecular FormulaC10H12FN3O
Molecular Weight209.22 g/mol
Exact Mass209.10
IUPAC Name2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol
SMILESCn1c(C(N)CO)cc2ncc(F)cc21
InChIInChI=1S/C10H12FN3O/c1-14-9(7(12)5-15)3-8-10(14)2-6(11)4-13-8/h2-4,7,15H,5,12H2,1H3
InChIKeyACCXGUUDHYCNFA-UHFFFAOYSA-N
XLogP0.70
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol?
The IUPAC name of 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol (CID 84780514) is 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol.
What is the SMILES notation for 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol?
The canonical SMILES for 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol is Cn1c(C(N)CO)cc2ncc(F)cc21.
What is the InChIKey of 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol?
The InChIKey is ACCXGUUDHYCNFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3O/c1-14-9(7(12)5-15)3-8-10(14)2-6(11)4-13-8/h2-4,7,15H,5,12H2,1H3.
What are the key properties of 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol?
2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol has a molecular weight of 209.22 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(6-fluoro-1-methylpyrrolo[3,2-b]pyridin-2-yl)ethanol is sourced from PubChem (CID 84780514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).