5-naphthalen-2-ylsulfanylpentanehydrazide

C15H18N2OS — CID 55213311

IUPAC5-naphthalen-2-ylsulfanylpentanehydrazide
SMILESNNC(=O)CCCCSc1ccc2ccccc2c1
InChIInChI=1S/C15H18N2OS/c16-17-15(18)7-3-4-10-19-14-9-8-12-5-1-2-6-13(12)11-14/h1-2,5-6,8-9,11H,3-4,7,10,16H2,(H,17,18)
InChIKeyISYGDBDDNJKMAV-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.09
Rot. Bonds6

About 5-naphthalen-2-ylsulfanylpentanehydrazide

5-naphthalen-2-ylsulfanylpentanehydrazide (PubChem CID 55213311) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 5-naphthalen-2-ylsulfanylpentanehydrazide.

Molecular Properties

Compound Name5-naphthalen-2-ylsulfanylpentanehydrazide
PubChem CID55213311
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name5-naphthalen-2-ylsulfanylpentanehydrazide
SMILESNNC(=O)CCCCSc1ccc2ccccc2c1
InChIInChI=1S/C15H18N2OS/c16-17-15(18)7-3-4-10-19-14-9-8-12-5-1-2-6-13(12)11-14/h1-2,5-6,8-9,11H,3-4,7,10,16H2,(H,17,18)
InChIKeyISYGDBDDNJKMAV-UHFFFAOYSA-N
XLogP3.09
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl 6-naphthalen-2-ylsulfanylhexanoate
CID 135366329
5-(3-methoxyphenyl)sulfanylpentanehydrazide
CID 63580608
4-(4-fluorophenyl)sulfanylbutanehydrazide
CID 63580028
5-naphthalen-2-ylsulfanylpentanimidamide
CID 54965805
4-(4-amino-3-chlorophenyl)sulfanylbutanehydrazide
CID 79149650
2-(4-chlorobutylsulfanyl)naphthalene
CID 63501641
formic acid;2-propylsulfanylnaphthalene
CID 143073136
2-methyl-9-naphthalen-2-ylsulfanylnon-2-enoic acid
CID 155672864
3-(4-aminophenyl)sulfanylpropanehydrazide
CID 63580911
5-thiophen-2-ylsulfanylpentanehydrazide
CID 63580812
ethyl 3-anthracen-2-ylsulfanylpropanoate
CID 11659590
5-[(2-naphthalen-2-ylsulfanylacetyl)amino]pentanoic acid
CID 119235112

Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-2-ylsulfanylpentanehydrazide?
The IUPAC name of 5-naphthalen-2-ylsulfanylpentanehydrazide (CID 55213311) is 5-naphthalen-2-ylsulfanylpentanehydrazide.
What is the SMILES notation for 5-naphthalen-2-ylsulfanylpentanehydrazide?
The canonical SMILES for 5-naphthalen-2-ylsulfanylpentanehydrazide is NNC(=O)CCCCSc1ccc2ccccc2c1.
What is the InChIKey of 5-naphthalen-2-ylsulfanylpentanehydrazide?
The InChIKey is ISYGDBDDNJKMAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c16-17-15(18)7-3-4-10-19-14-9-8-12-5-1-2-6-13(12)11-14/h1-2,5-6,8-9,11H,3-4,7,10,16H2,(H,17,18).
What are the key properties of 5-naphthalen-2-ylsulfanylpentanehydrazide?
5-naphthalen-2-ylsulfanylpentanehydrazide has a molecular weight of 274.39 g/mol, XLogP of 3.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-2-ylsulfanylpentanehydrazide is sourced from PubChem (CID 55213311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).