N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide

C16H15N3O3 — CID 87266323

IUPACN-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide
SMILESO=C(NO)c1cc2c(ccn2CCOc2ccccc2)cn1
InChIInChI=1S/C16H15N3O3/c20-16(18-21)14-10-15-12(11-17-14)6-7-19(15)8-9-22-13-4-2-1-3-5-13/h1-7,10-11,21H,8-9H2,(H,18,20)
InChIKeyWBTXEIRYMNVMLP-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.23
Rot. Bonds5

About N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide

N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide (PubChem CID 87266323) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide
PubChem CID87266323
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC NameN-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide
SMILESO=C(NO)c1cc2c(ccn2CCOc2ccccc2)cn1
InChIInChI=1S/C16H15N3O3/c20-16(18-21)14-10-15-12(11-17-14)6-7-19(15)8-9-22-13-4-2-1-3-5-13/h1-7,10-11,21H,8-9H2,(H,18,20)
InChIKeyWBTXEIRYMNVMLP-UHFFFAOYSA-N
XLogP2.23
TPSA76.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 52.23
H-Bond Donors ≤ 52
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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Related Compounds

1-[(2-chlorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
CID 87265967
1-[(2-fluorophenyl)methyl]-N-hydroxypyrrolo[3,2-c]pyridine-6-carboxamide
CID 87266262
N-hydroxy-1-(pyridin-4-ylmethyl)pyrrolo[3,2-c]pyridine-6-carboxamide
CID 87266028
3-(2-indol-1-ylethoxy)benzoic acid
CID 43532512
1-(2-cyclohexylethyl)-N-hydroxypyrrolo[2,3-c]pyridine-5-carboxamide
CID 11623393
2-[1-(2-phenoxyethyl)indol-6-yl]ethanamine
CID 102917753
N-hydroxy-1-oxo-2-[3-(4-phenoxyphenoxy)propyl]isoquinoline-7-carboxamide
CID 87688679
1-[1-(2-phenoxyethyl)pyrrol-2-yl]ethanone
CID 79107007
methyl 1-[2-(4-fluorophenoxy)ethyl]indole-6-carboxylate
CID 5191010
1-[2-(4-chloro-2-fluorophenoxy)ethyl]-N-hydroxyindole-6-carboxamide
CID 87266182
5-methoxy-1-(3-phenoxypropyl)indole
CID 110831444
1-[2-[3-[[2-[2-(3-cyclopentylpropoxy)ethoxy]ethyl-methylamino]methyl]phenoxy]ethyl]-N-hydroxyindole-6-carboxamide
CID 170703879

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide?
The IUPAC name of N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide (CID 87266323) is N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide.
What is the SMILES notation for N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide?
The canonical SMILES for N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide is O=C(NO)c1cc2c(ccn2CCOc2ccccc2)cn1.
What is the InChIKey of N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide?
The InChIKey is WBTXEIRYMNVMLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c20-16(18-21)14-10-15-12(11-17-14)6-7-19(15)8-9-22-13-4-2-1-3-5-13/h1-7,10-11,21H,8-9H2,(H,18,20).
What are the key properties of N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide?
N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide has a molecular weight of 297.31 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-1-(2-phenoxyethyl)pyrrolo[3,2-c]pyridine-6-carboxamide is sourced from PubChem (CID 87266323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).