5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol

C11H15ClN4O — CID 114148456

IUPAC5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol
SMILESCC(O)CCCNc1nc2ccc(Cl)cn2n1
InChIInChI=1S/C11H15ClN4O/c1-8(17)3-2-6-13-11-14-10-5-4-9(12)7-16(10)15-11/h4-5,7-8,17H,2-3,6H2,1H3,(H,13,15)
InChIKeyFUQGYOPSYKDPQH-UHFFFAOYSA-N
MW254.72 g/mol
LogP1.96
Rot. Bonds5

About 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol

5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol (PubChem CID 114148456) has the molecular formula C11H15ClN4O and a molecular weight of 254.72 g/mol. Its IUPAC name is 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol.

Molecular Properties

Compound Name5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol
PubChem CID114148456
Molecular FormulaC11H15ClN4O
Molecular Weight254.72 g/mol
Exact Mass254.09
IUPAC Name5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol
SMILESCC(O)CCCNc1nc2ccc(Cl)cn2n1
InChIInChI=1S/C11H15ClN4O/c1-8(17)3-2-6-13-11-14-10-5-4-9(12)7-16(10)15-11/h4-5,7-8,17H,2-3,6H2,1H3,(H,13,15)
InChIKeyFUQGYOPSYKDPQH-UHFFFAOYSA-N
XLogP1.96
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.72
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-2-methylpentan-1-ol
CID 114152105
6-chloro-N-[(4-ethylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106900179
4-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-3,3-dimethylbutan-1-ol
CID 114150223
6-chloro-N-[2-(cyclopenten-1-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106177699
6-chloro-N-[(4-methyl-3-pyridinyl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 114956565
6-methyl-N-(2-propan-2-yloxyethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 113450398
6-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]hexan-1-ol
CID 107850356
1-[2-([1,2,4]triazolo[1,5-a]pyridin-2-ylamino)ethylamino]propan-2-ol
CID 113430486
6-chloro-N-(1,4-dithian-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 113489449
5-[(6-chloro-2-methylpyrimidin-4-yl)amino]pentan-2-ol
CID 107269267
6-methyl-N-(3-methylsulfinylpropyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 113487734
2-(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-N,3-dimethylbutan-1-amine
CID 116990174

Frequently Asked Questions

What is the IUPAC name of 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol?
The IUPAC name of 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol (CID 114148456) is 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol.
What is the SMILES notation for 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol?
The canonical SMILES for 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol is CC(O)CCCNc1nc2ccc(Cl)cn2n1.
What is the InChIKey of 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol?
The InChIKey is FUQGYOPSYKDPQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN4O/c1-8(17)3-2-6-13-11-14-10-5-4-9(12)7-16(10)15-11/h4-5,7-8,17H,2-3,6H2,1H3,(H,13,15).
What are the key properties of 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol?
5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol has a molecular weight of 254.72 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]pentan-2-ol is sourced from PubChem (CID 114148456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).