N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide

C19H18N2O2S — CID 42386767

IUPACN'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide
SMILESO=C(CCc1cccs1)NNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C19H18N2O2S/c22-18(11-10-16-8-4-12-24-16)20-21-19(23)13-15-7-3-6-14-5-1-2-9-17(14)15/h1-9,12H,10-11,13H2,(H,20,22)(H,21,23)
InChIKeyFVPUPRDKZIKGKT-UHFFFAOYSA-N
MW338.43 g/mol
LogP3.22
Rot. Bonds5

About N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide

N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide (PubChem CID 42386767) has the molecular formula C19H18N2O2S and a molecular weight of 338.43 g/mol. Its IUPAC name is N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide.

Molecular Properties

Compound NameN'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide
PubChem CID42386767
Molecular FormulaC19H18N2O2S
Molecular Weight338.43 g/mol
Exact Mass338.11
IUPAC NameN'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide
SMILESO=C(CCc1cccs1)NNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C19H18N2O2S/c22-18(11-10-16-8-4-12-24-16)20-21-19(23)13-15-7-3-6-14-5-1-2-9-17(14)15/h1-9,12H,10-11,13H2,(H,20,22)(H,21,23)
InChIKeyFVPUPRDKZIKGKT-UHFFFAOYSA-N
XLogP3.22
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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2-naphthalen-1-yl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]acetamide
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N'-(3-thiophen-2-ylpropanoyl)benzohydrazide
CID 30859496
4-[2-(2-naphthalen-1-ylacetyl)hydrazinyl]-4-oxobutanoate
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N'-methyl-3-thiophen-2-ylpropanehydrazide
CID 116846300
N-(quinolin-2-ylmethyl)-3-thiophen-2-ylpropanamide
CID 110734093
N-[(3-bromophenyl)methyl]-3-thiophen-2-ylpropanamide
CID 52570732
N-ethyl-2-naphthalen-1-yl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]acetamide
CID 8960860
2-(naphthalen-1-ylmethyl)thiophene
CID 23454862
1-naphthalen-1-yl-N-(thiophen-2-ylmethyl)methanamine;hydrochloride
CID 17289837
[2-oxo-2-(thiophen-2-ylmethylamino)ethyl] naphthalene-1-carboxylate
CID 2364071

Frequently Asked Questions

What is the IUPAC name of N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide?
The IUPAC name of N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide (CID 42386767) is N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide.
What is the SMILES notation for N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide?
The canonical SMILES for N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide is O=C(CCc1cccs1)NNC(=O)Cc1cccc2ccccc12.
What is the InChIKey of N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide?
The InChIKey is FVPUPRDKZIKGKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2S/c22-18(11-10-16-8-4-12-24-16)20-21-19(23)13-15-7-3-6-14-5-1-2-9-17(14)15/h1-9,12H,10-11,13H2,(H,20,22)(H,21,23).
What are the key properties of N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide?
N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide has a molecular weight of 338.43 g/mol, XLogP of 3.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide is sourced from PubChem (CID 42386767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).