4-(6-methylnaphthalen-2-yl)butanehydrazide

C15H18N2O — CID 116843668

IUPAC4-(6-methylnaphthalen-2-yl)butanehydrazide
SMILESCc1ccc2cc(CCCC(=O)NN)ccc2c1
InChIInChI=1S/C15H18N2O/c1-11-5-7-14-10-12(6-8-13(14)9-11)3-2-4-15(18)17-16/h5-10H,2-4,16H2,1H3,(H,17,18)
InChIKeyPJVPANDQSYIXOW-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.46
Rot. Bonds4

About 4-(6-methylnaphthalen-2-yl)butanehydrazide

4-(6-methylnaphthalen-2-yl)butanehydrazide (PubChem CID 116843668) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 4-(6-methylnaphthalen-2-yl)butanehydrazide.

Molecular Properties

Compound Name4-(6-methylnaphthalen-2-yl)butanehydrazide
PubChem CID116843668
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name4-(6-methylnaphthalen-2-yl)butanehydrazide
SMILESCc1ccc2cc(CCCC(=O)NN)ccc2c1
InChIInChI=1S/C15H18N2O/c1-11-5-7-14-10-12(6-8-13(14)9-11)3-2-4-15(18)17-16/h5-10H,2-4,16H2,1H3,(H,17,18)
InChIKeyPJVPANDQSYIXOW-UHFFFAOYSA-N
XLogP2.46
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[6-(3-hydrazinyl-3-oxopropyl)naphthalen-2-yl]propanehydrazide
CID 166059452
N'-methyl-3-(6-methylnaphthalen-2-yl)propanehydrazide
CID 116846437
N',N'-dimethyl-3-(6-methylnaphthalen-2-yl)propanehydrazide
CID 116847656
5-(4-methoxyphenyl)pentanehydrazide
CID 59015987
9-(6-methylnaphthalen-2-yl)nonyl acetate
CID 171920221
3-(2,4-dimethylphenyl)propanehydrazide
CID 116843444
2-[2-(6-methylnaphthalen-2-yl)ethylamino]acetamide
CID 115260174
4-(3-chloro-4-methoxyphenyl)butanehydrazide
CID 116843564
5-(3,4-difluorophenyl)pentanehydrazide
CID 116843725
5-(6-methylindol-1-yl)pentanehydrazide
CID 63577406
N'-[2-(6-methylnaphthalen-2-yl)ethyl]ethane-1,2-diamine
CID 115195493
4-(1-methylbenzimidazol-5-yl)butanehydrazide
CID 116843638

Frequently Asked Questions

What is the IUPAC name of 4-(6-methylnaphthalen-2-yl)butanehydrazide?
The IUPAC name of 4-(6-methylnaphthalen-2-yl)butanehydrazide (CID 116843668) is 4-(6-methylnaphthalen-2-yl)butanehydrazide.
What is the SMILES notation for 4-(6-methylnaphthalen-2-yl)butanehydrazide?
The canonical SMILES for 4-(6-methylnaphthalen-2-yl)butanehydrazide is Cc1ccc2cc(CCCC(=O)NN)ccc2c1.
What is the InChIKey of 4-(6-methylnaphthalen-2-yl)butanehydrazide?
The InChIKey is PJVPANDQSYIXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11-5-7-14-10-12(6-8-13(14)9-11)3-2-4-15(18)17-16/h5-10H,2-4,16H2,1H3,(H,17,18).
What are the key properties of 4-(6-methylnaphthalen-2-yl)butanehydrazide?
4-(6-methylnaphthalen-2-yl)butanehydrazide has a molecular weight of 242.32 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methylnaphthalen-2-yl)butanehydrazide is sourced from PubChem (CID 116843668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).