N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C12H12FN5O — CID 106373573

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCCc1cnc(CNc2nc3ccc(F)cn3n2)o1
InChIInChI=1S/C12H12FN5O/c1-2-9-5-14-11(19-9)6-15-12-16-10-4-3-8(13)7-18(10)17-12/h3-5,7H,2,6H2,1H3,(H,15,17)
InChIKeyUVKAIVBVCAYPPS-UHFFFAOYSA-N
MW261.26 g/mol
LogP2.03
Rot. Bonds4

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 106373573) has the molecular formula C12H12FN5O and a molecular weight of 261.26 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID106373573
Molecular FormulaC12H12FN5O
Molecular Weight261.26 g/mol
Exact Mass261.10
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCCc1cnc(CNc2nc3ccc(F)cn3n2)o1
InChIInChI=1S/C12H12FN5O/c1-2-9-5-14-11(19-9)6-15-12-16-10-4-3-8(13)7-18(10)17-12/h3-5,7H,2,6H2,1H3,(H,15,17)
InChIKeyUVKAIVBVCAYPPS-UHFFFAOYSA-N
XLogP2.03
TPSA68.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.26
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 106373573) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine is CCc1cnc(CNc2nc3ccc(F)cn3n2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is UVKAIVBVCAYPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FN5O/c1-2-9-5-14-11(19-9)6-15-12-16-10-4-3-8(13)7-18(10)17-12/h3-5,7H,2,6H2,1H3,(H,15,17).
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 261.26 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 106373573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).