4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide

C21H17ClN4O2 — CID 177377262

IUPAC4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(NCc2cc(-c3cccc(Cl)c3)cn3ccnc23)cc1
InChIInChI=1S/C21H17ClN4O2/c22-18-3-1-2-15(11-18)17-10-16(20-23-8-9-26(20)13-17)12-24-19-6-4-14(5-7-19)21(27)25-28/h1-11,13,24,28H,12H2,(H,25,27)
InChIKeyHGOKOYTXAMNFSZ-UHFFFAOYSA-N
MW392.85 g/mol
LogP4.39
Rot. Bonds5

About 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide

4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide (PubChem CID 177377262) has the molecular formula C21H17ClN4O2 and a molecular weight of 392.85 g/mol. Its IUPAC name is 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide.

Molecular Properties

Compound Name4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide
PubChem CID177377262
Molecular FormulaC21H17ClN4O2
Molecular Weight392.85 g/mol
Exact Mass392.10
IUPAC Name4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(NCc2cc(-c3cccc(Cl)c3)cn3ccnc23)cc1
InChIInChI=1S/C21H17ClN4O2/c22-18-3-1-2-15(11-18)17-10-16(20-23-8-9-26(20)13-17)12-24-19-6-4-14(5-7-19)21(27)25-28/h1-11,13,24,28H,12H2,(H,25,27)
InChIKeyHGOKOYTXAMNFSZ-UHFFFAOYSA-N
XLogP4.39
TPSA78.66 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.85
LogP ≤ 54.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', '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 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide?
The IUPAC name of 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide (CID 177377262) is 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide.
What is the SMILES notation for 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide?
The canonical SMILES for 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide is O=C(NO)c1ccc(NCc2cc(-c3cccc(Cl)c3)cn3ccnc23)cc1.
What is the InChIKey of 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide?
The InChIKey is HGOKOYTXAMNFSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN4O2/c22-18-3-1-2-15(11-18)17-10-16(20-23-8-9-26(20)13-17)12-24-19-6-4-14(5-7-19)21(27)25-28/h1-11,13,24,28H,12H2,(H,25,27).
What are the key properties of 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide?
4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide has a molecular weight of 392.85 g/mol, XLogP of 4.39, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[6-(3-chlorophenyl)imidazo[1,2-a]pyridin-8-yl]methylamino]-N-hydroxybenzamide is sourced from PubChem (CID 177377262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).