N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide

C12H12N2O3S — CID 47123763

IUPACN'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide
SMILESO=C(CCc1ccco1)NNC(=O)c1cccs1
InChIInChI=1S/C12H12N2O3S/c15-11(6-5-9-3-1-7-17-9)13-14-12(16)10-4-2-8-18-10/h1-4,7-8H,5-6H2,(H,13,15)(H,14,16)
InChIKeyMWFWSGAVICFGGI-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.73
Rot. Bonds4

About N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide

N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide (PubChem CID 47123763) has the molecular formula C12H12N2O3S and a molecular weight of 264.31 g/mol. Its IUPAC name is N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide.

Molecular Properties

Compound NameN'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide
PubChem CID47123763
Molecular FormulaC12H12N2O3S
Molecular Weight264.31 g/mol
Exact Mass264.06
IUPAC NameN'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide
SMILESO=C(CCc1ccco1)NNC(=O)c1cccs1
InChIInChI=1S/C12H12N2O3S/c15-11(6-5-9-3-1-7-17-9)13-14-12(16)10-4-2-8-18-10/h1-4,7-8H,5-6H2,(H,13,15)(H,14,16)
InChIKeyMWFWSGAVICFGGI-UHFFFAOYSA-N
XLogP1.73
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-N',4-N'-bis(thiophene-2-carbonyl)butanedihydrazide
CID 3715888
2-(furan-2-yl)-1-thiophen-2-ylethanone
CID 83173067
N-[2-[4-(furan-2-yl)butan-2-ylamino]-2-oxoethyl]thiophene-2-carboxamide
CID 18162547
3-(furan-2-yl)-N-(1-thiophen-2-ylethyl)propanamide
CID 43005308
N-(furan-2-ylmethyl)-4-[(thiophene-2-carbonylamino)carbamoyl]benzenesulfonamide
CID 4788612
N'-[2-(2,6-dichlorophenyl)acetyl]thiophene-2-carbohydrazide
CID 7600829
N'-[1-(furan-2-yl)ethenyl]thiophene-2-carbohydrazide
CID 2715141
N-(furan-2-ylmethyl)-4-oxo-4-thiophen-2-ylbutanamide
CID 18108046
3-(furan-2-yl)-N,N-bis(thiophen-2-ylmethyl)propanamide
CID 52556210
N'-[2-(4-chlorophenyl)acetyl]thiophene-2-carbohydrazide
CID 809192
N'-(3-phenylsulfanylpropanoyl)thiophene-2-carbohydrazide
CID 9479389
[2-oxo-2-[2-(thiophene-2-carbonyl)hydrazinyl]ethyl] carbamate
CID 175436471

Frequently Asked Questions

What is the IUPAC name of N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide?
The IUPAC name of N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide (CID 47123763) is N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide.
What is the SMILES notation for N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide?
The canonical SMILES for N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide is O=C(CCc1ccco1)NNC(=O)c1cccs1.
What is the InChIKey of N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide?
The InChIKey is MWFWSGAVICFGGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3S/c15-11(6-5-9-3-1-7-17-9)13-14-12(16)10-4-2-8-18-10/h1-4,7-8H,5-6H2,(H,13,15)(H,14,16).
What are the key properties of N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide?
N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide has a molecular weight of 264.31 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-(furan-2-yl)propanoyl]thiophene-2-carbohydrazide is sourced from PubChem (CID 47123763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).