N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide

C14H15N3O3S — CID 58157746

IUPACN-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide
SMILESCn1cccc1C(=O)N1CCc2cc(C(=O)NO)sc2C1
InChIInChI=1S/C14H15N3O3S/c1-16-5-2-3-10(16)14(19)17-6-4-9-7-11(13(18)15-20)21-12(9)8-17/h2-3,5,7,20H,4,6,8H2,1H3,(H,15,18)
InChIKeyRDSDFOQTIQSZSO-UHFFFAOYSA-N
MW305.36 g/mol
LogP1.40
Rot. Bonds2

About N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide

N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide (PubChem CID 58157746) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide
PubChem CID58157746
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC NameN-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide
SMILESCn1cccc1C(=O)N1CCc2cc(C(=O)NO)sc2C1
InChIInChI=1S/C14H15N3O3S/c1-16-5-2-3-10(16)14(19)17-6-4-9-7-11(13(18)15-20)21-12(9)8-17/h2-3,5,7,20H,4,6,8H2,1H3,(H,15,18)
InChIKeyRDSDFOQTIQSZSO-UHFFFAOYSA-N
XLogP1.40
TPSA74.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 51.40
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'}

Analyze N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide (CID 58157746) is N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide is Cn1cccc1C(=O)N1CCc2cc(C(=O)NO)sc2C1.
What is the InChIKey of N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide?
The InChIKey is RDSDFOQTIQSZSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-16-5-2-3-10(16)14(19)17-6-4-9-7-11(13(18)15-20)21-12(9)8-17/h2-3,5,7,20H,4,6,8H2,1H3,(H,15,18).
What are the key properties of N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide?
N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide has a molecular weight of 305.36 g/mol, XLogP of 1.40, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-6-(1-methylpyrrole-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 58157746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).