2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol

C18H18N8O — CID 167146802

IUPAC2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol
SMILES[H]/N=N/c1ccc(-c2cnn(CCO)c2)nc1NCc1ccc2nccn2c1
InChIInChI=1S/C18H18N8O/c19-24-16-3-2-15(14-10-22-26(12-14)7-8-27)23-18(16)21-9-13-1-4-17-20-5-6-25(17)11-13/h1-6,10-12,19,27H,7-9H2,(H,21,23)/b24-19+
InChIKeyLWJOSORCLUQISX-LYBHJNIJSA-N
MW362.40 g/mol
LogP2.86
Rot. Bonds7

About 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol

2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol (PubChem CID 167146802) has the molecular formula C18H18N8O and a molecular weight of 362.40 g/mol. Its IUPAC name is 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol
PubChem CID167146802
Molecular FormulaC18H18N8O
Molecular Weight362.40 g/mol
Exact Mass362.16
IUPAC Name2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol
SMILES[H]/N=N/c1ccc(-c2cnn(CCO)c2)nc1NCc1ccc2nccn2c1
InChIInChI=1S/C18H18N8O/c19-24-16-3-2-15(14-10-22-26(12-14)7-8-27)23-18(16)21-9-13-1-4-17-20-5-6-25(17)11-13/h1-6,10-12,19,27H,7-9H2,(H,21,23)/b24-19+
InChIKeyLWJOSORCLUQISX-LYBHJNIJSA-N
XLogP2.86
TPSA116.48 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 52.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

2-[4-[5-amino-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)pyrazin-2-yl]pyrazol-1-yl]ethanol
CID 139321220
6-(1-ethylpyrazol-4-yl)-2-N-(imidazo[1,2-a]pyridin-6-ylmethyl)pyridine-2,3-diamine
CID 155149835
3-hydrazinyl-N-(imidazo[1,2-a]pyridin-6-ylmethyl)-6-(1-propylpyrazol-4-yl)pyrazin-2-amine
CID 155150035
2-N-(imidazo[1,2-a]pyridin-6-ylmethyl)-3-N-methyl-6-(1-propan-2-ylpyrazol-4-yl)pyridine-2,3-diamine
CID 123363206
2-[4-[5-hydrazinyl-6-(imidazo[1,2-b]pyridazin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol
CID 167146775
3-hydrazinyl-N-(imidazo[1,2-a]pyridin-6-ylmethyl)-6-[1-(oxan-4-yl)pyrazol-4-yl]pyridin-2-amine
CID 139321225
N-[(3-bromoimidazo[1,2-a]pyridin-6-yl)methyl]-3-diazenyl-6-(1-methylpyrazol-4-yl)pyrazin-2-amine
CID 155150047
6-[[3-(1-propylpyrazol-4-yl)-2,7,8-triazabicyclo[4.2.0]octa-1(6),2,4-trien-8-yl]methyl]imidazo[1,2-a]pyridine
CID 118214093
3-diazenyl-6-(1-methylpyrazol-4-yl)-N-[[3-(propan-2-yloxymethyl)imidazo[1,2-a]pyridin-6-yl]methyl]pyrazin-2-amine
CID 167146875
imidazo[1,2-a]pyridin-6-ylmethanol;hydrochloride
CID 71748611
2-[4-[5-amino-6-[(7-methyl-1,5-naphthyridin-2-yl)methylamino]-2-pyridinyl]pyrazol-1-yl]ethanol
CID 123940357
4-[5-diazenyl-6-(quinolin-6-ylmethylamino)-2-pyridinyl]-N-(2-hydroxyethoxy)-2-methylbenzamide
CID 123969609

Frequently Asked Questions

What is the IUPAC name of 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol (CID 167146802) is 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol is [H]/N=N/c1ccc(-c2cnn(CCO)c2)nc1NCc1ccc2nccn2c1.
What is the InChIKey of 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol?
The InChIKey is LWJOSORCLUQISX-LYBHJNIJSA-N. The full InChI is InChI=1S/C18H18N8O/c19-24-16-3-2-15(14-10-22-26(12-14)7-8-27)23-18(16)21-9-13-1-4-17-20-5-6-25(17)11-13/h1-6,10-12,19,27H,7-9H2,(H,21,23)/b24-19+.
What are the key properties of 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol?
2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol has a molecular weight of 362.40 g/mol, XLogP of 2.86, 7 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[5-diazenyl-6-(imidazo[1,2-a]pyridin-6-ylmethylamino)-2-pyridinyl]pyrazol-1-yl]ethanol is sourced from PubChem (CID 167146802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).