N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C16H14N4O2 — CID 135734586

IUPACN-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2ccccn2c1C(=O)N/N=C/c1ccc(O)cc1
InChIInChI=1S/C16H14N4O2/c1-11-15(20-9-3-2-4-14(20)18-11)16(22)19-17-10-12-5-7-13(21)8-6-12/h2-10,21H,1H3,(H,19,22)/b17-10+
InChIKeyOPYGLACUVAPHFP-LICLKQGHSA-N
MW294.31 g/mol
LogP2.11
Rot. Bonds3

About N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 135734586) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID135734586
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC NameN-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2ccccn2c1C(=O)N/N=C/c1ccc(O)cc1
InChIInChI=1S/C16H14N4O2/c1-11-15(20-9-3-2-4-14(20)18-11)16(22)19-17-10-12-5-7-13(21)8-6-12/h2-10,21H,1H3,(H,19,22)/b17-10+
InChIKeyOPYGLACUVAPHFP-LICLKQGHSA-N
XLogP2.11
TPSA78.99 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 135734586) is N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2ccccn2c1C(=O)N/N=C/c1ccc(O)cc1.
What is the InChIKey of N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is OPYGLACUVAPHFP-LICLKQGHSA-N. The full InChI is InChI=1S/C16H14N4O2/c1-11-15(20-9-3-2-4-14(20)18-11)16(22)19-17-10-12-5-7-13(21)8-6-12/h2-10,21H,1H3,(H,19,22)/b17-10+.
What are the key properties of N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 135734586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).