2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol

C12H17N3O — CID 63559839

IUPAC2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol
SMILESCCC(O)C(C)c1cc(C)cc2ncnn12
InChIInChI=1S/C12H17N3O/c1-4-11(16)9(3)10-5-8(2)6-12-13-7-14-15(10)12/h5-7,9,11,16H,4H2,1-3H3
InChIKeyVPOPJVXWJMKCCD-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.91
Rot. Bonds3

About 2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol

2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol (PubChem CID 63559839) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol.

Molecular Properties

Compound Name2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol
PubChem CID63559839
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol
SMILESCCC(O)C(C)c1cc(C)cc2ncnn12
InChIInChI=1S/C12H17N3O/c1-4-11(16)9(3)10-5-8(2)6-12-13-7-14-15(10)12/h5-7,9,11,16H,4H2,1-3H3
InChIKeyVPOPJVXWJMKCCD-UHFFFAOYSA-N
XLogP1.91
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-ol
CID 63201068
4-methyl-3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-2-amine
CID 63197968
3-methyl-4-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]butanoic acid
CID 81065472
N-hexan-3-yl-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 62046630
5-(2-bromobutyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 63203897
3-methyl-2-[[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]methyl]butanoic acid
CID 65226758
2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]-1-phenylethanol
CID 43232822
3-methyl-4-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]butan-1-ol
CID 66106462
N-(1-chloropropan-2-yl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 65029049
N-butan-2-yl-3-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]propanamide
CID 60966544
N-(2-chloro-3-ethylpentyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 106286878
N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine
CID 63202350

Frequently Asked Questions

What is the IUPAC name of 2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol?
The IUPAC name of 2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol (CID 63559839) is 2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol.
What is the SMILES notation for 2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol?
The canonical SMILES for 2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol is CCC(O)C(C)c1cc(C)cc2ncnn12.
What is the InChIKey of 2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol?
The InChIKey is VPOPJVXWJMKCCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-4-11(16)9(3)10-5-8(2)6-12-13-7-14-15(10)12/h5-7,9,11,16H,4H2,1-3H3.
What are the key properties of 2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol?
2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol has a molecular weight of 219.29 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 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)pentan-3-ol is sourced from PubChem (CID 63559839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).