[2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol

C16H16N4O — CID 82355672

IUPAC[2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol
SMILESCc1ccccc1/N=N/c1c(C)nc2c(CO)cccn12
InChIInChI=1S/C16H16N4O/c1-11-6-3-4-8-14(11)18-19-15-12(2)17-16-13(10-21)7-5-9-20(15)16/h3-9,21H,10H2,1-2H3/b19-18+
InChIKeyMHXKBOOUVNJUFM-VHEBQXMUSA-N
MW280.33 g/mol
LogP3.86
Rot. Bonds3

About [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol

[2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol (PubChem CID 82355672) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol.

Molecular Properties

Compound Name[2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol
PubChem CID82355672
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name[2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol
SMILESCc1ccccc1/N=N/c1c(C)nc2c(CO)cccn12
InChIInChI=1S/C16H16N4O/c1-11-6-3-4-8-14(11)18-19-15-12(2)17-16-13(10-21)7-5-9-20(15)16/h3-9,21H,10H2,1-2H3/b19-18+
InChIKeyMHXKBOOUVNJUFM-VHEBQXMUSA-N
XLogP3.86
TPSA62.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

[3-[(2-methoxyphenyl)diazenyl]-2-methylimidazo[1,2-a]pyridin-8-yl]methanol
CID 82355678
[3-[(3,4-dimethylphenyl)diazenyl]-2-methylimidazo[1,2-a]pyridin-8-yl]methanol
CID 82355660
3-[(2-methylphenyl)diazenyl]-2-propan-2-ylimidazo[1,2-a]pyridin-8-ol
CID 82355729
3-[(2,6-dimethylphenyl)diazenyl]-2-methylimidazo[1,2-a]pyridin-8-ol
CID 82355705
[3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol
CID 82356589
[3-[(2-methoxyphenyl)diazenyl]-2-methylimidazo[1,2-a]pyridin-7-yl]methanol
CID 82355644
ethyl 3-amino-8-(hydroxymethyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 82355967
2-[(2-methylimidazo[1,2-a]pyridin-3-yl)diazenyl]benzoic acid
CID 82355458
(3-nitroso-2-thiophen-2-ylimidazo[1,2-a]pyridin-8-yl)methanol
CID 82356574
[8-(2,3-dihydro-1H-inden-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-3-yl]methanol
CID 70414109
[3-amino-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol
CID 82355981
[3-[(2,5-dimethylphenyl)diazenyl]-2-methylimidazo[1,2-a]pyridin-6-yl]methanol
CID 82355591

Frequently Asked Questions

What is the IUPAC name of [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol?
The IUPAC name of [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol (CID 82355672) is [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol.
What is the SMILES notation for [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol?
The canonical SMILES for [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol is Cc1ccccc1/N=N/c1c(C)nc2c(CO)cccn12.
What is the InChIKey of [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol?
The InChIKey is MHXKBOOUVNJUFM-VHEBQXMUSA-N. The full InChI is InChI=1S/C16H16N4O/c1-11-6-3-4-8-14(11)18-19-15-12(2)17-16-13(10-21)7-5-9-20(15)16/h3-9,21H,10H2,1-2H3/b19-18+.
What are the key properties of [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol?
[2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol has a molecular weight of 280.33 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-3-[(2-methylphenyl)diazenyl]imidazo[1,2-a]pyridin-8-yl]methanol is sourced from PubChem (CID 82355672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).