2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol

C15H16N4O — CID 43232822

IUPAC2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol
SMILESCc1cc(NCC(O)c2ccccc2)n2ncnc2c1
InChIInChI=1S/C15H16N4O/c1-11-7-14(19-15(8-11)17-10-18-19)16-9-13(20)12-5-3-2-4-6-12/h2-8,10,13,16,20H,9H2,1H3
InChIKeyYBBIMXQXDPBOTH-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.18
Rot. Bonds4

About 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol

2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol (PubChem CID 43232822) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol.

Molecular Properties

Compound Name2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol
PubChem CID43232822
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol
SMILESCc1cc(NCC(O)c2ccccc2)n2ncnc2c1
InChIInChI=1S/C15H16N4O/c1-11-7-14(19-15(8-11)17-10-18-19)16-9-13(20)12-5-3-2-4-6-12/h2-8,10,13,16,20H,9H2,1H3
InChIKeyYBBIMXQXDPBOTH-UHFFFAOYSA-N
XLogP2.18
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol?
The IUPAC name of 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol (CID 43232822) is 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol.
What is the SMILES notation for 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol?
The canonical SMILES for 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol is Cc1cc(NCC(O)c2ccccc2)n2ncnc2c1.
What is the InChIKey of 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol?
The InChIKey is YBBIMXQXDPBOTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-11-7-14(19-15(8-11)17-10-18-19)16-9-13(20)12-5-3-2-4-6-12/h2-8,10,13,16,20H,9H2,1H3.
What are the key properties of 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol?
2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol has a molecular weight of 268.32 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol is sourced from PubChem (CID 43232822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).