N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide

C15H14N4O3S — CID 78839550

IUPACN'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide
SMILESCc1oc(-c2cccs2)nc1CC(=O)NNC(=O)c1ccc[nH]1
InChIInChI=1S/C15H14N4O3S/c1-9-11(17-15(22-9)12-5-3-7-23-12)8-13(20)18-19-14(21)10-4-2-6-16-10/h2-7,16H,8H2,1H3,(H,18,20)(H,19,21)
InChIKeyDFUVGVWMPLXCOD-UHFFFAOYSA-N
MW330.37 g/mol
LogP2.04
Rot. Bonds4

About N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide

N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide (PubChem CID 78839550) has the molecular formula C15H14N4O3S and a molecular weight of 330.37 g/mol. Its IUPAC name is N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide
PubChem CID78839550
Molecular FormulaC15H14N4O3S
Molecular Weight330.37 g/mol
Exact Mass330.08
IUPAC NameN'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide
SMILESCc1oc(-c2cccs2)nc1CC(=O)NNC(=O)c1ccc[nH]1
InChIInChI=1S/C15H14N4O3S/c1-9-11(17-15(22-9)12-5-3-7-23-12)8-13(20)18-19-14(21)10-4-2-6-16-10/h2-7,16H,8H2,1H3,(H,18,20)(H,19,21)
InChIKeyDFUVGVWMPLXCOD-UHFFFAOYSA-N
XLogP2.04
TPSA100.02 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide with MolForge

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

Launch Full Analysis

Related Compounds

N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 24627442
5-ethyl-4-methyl-N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]thiophene-2-carbohydrazide
CID 25468869
N-(2-aminoethyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 119384938
N-(4-hydroxycyclohexyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 75361365
2-chloro-N-[2-[[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]amino]ethyl]benzamide
CID 55659288
2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 31046939
N-[[3-(methoxymethyl)phenyl]methyl]-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 46470860
benzyl 2-[[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]amino]acetate
CID 31046909
3-methoxy-N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-4-propan-2-yloxybenzohydrazide
CID 46514440
N-(4-chlorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 31780131
N-[(5-chlorothiophen-2-yl)methyl]-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 32832937
2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
CID 31765063

Frequently Asked Questions

What is the IUPAC name of N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide?
The IUPAC name of N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide (CID 78839550) is N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide.
What is the SMILES notation for N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide?
The canonical SMILES for N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide is Cc1oc(-c2cccs2)nc1CC(=O)NNC(=O)c1ccc[nH]1.
What is the InChIKey of N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide?
The InChIKey is DFUVGVWMPLXCOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3S/c1-9-11(17-15(22-9)12-5-3-7-23-12)8-13(20)18-19-14(21)10-4-2-6-16-10/h2-7,16H,8H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide?
N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide has a molecular weight of 330.37 g/mol, XLogP of 2.04, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetyl]-1H-pyrrole-2-carbohydrazide is sourced from PubChem (CID 78839550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).