2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride

C14H16Cl2N2O2 — CID 67024400

IUPAC2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride
SMILESCC(C)(Oc1ccc(Cl)c2ccccc12)C(=O)NN.Cl
InChIInChI=1S/C14H15ClN2O2.ClH/c1-14(2,13(18)17-16)19-12-8-7-11(15)9-5-3-4-6-10(9)12;/h3-8H,16H2,1-2H3,(H,17,18);1H
InChIKeyMAGJXZRZCPHXIZ-UHFFFAOYSA-N
MW315.20 g/mol
LogP3.06
Rot. Bonds3

About 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride

2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride (PubChem CID 67024400) has the molecular formula C14H16Cl2N2O2 and a molecular weight of 315.20 g/mol. Its IUPAC name is 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride.

Molecular Properties

Compound Name2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride
PubChem CID67024400
Molecular FormulaC14H16Cl2N2O2
Molecular Weight315.20 g/mol
Exact Mass314.06
IUPAC Name2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride
SMILESCC(C)(Oc1ccc(Cl)c2ccccc12)C(=O)NN.Cl
InChIInChI=1S/C14H15ClN2O2.ClH/c1-14(2,13(18)17-16)19-12-8-7-11(15)9-5-3-4-6-10(9)12;/h3-8H,16H2,1-2H3,(H,17,18);1H
InChIKeyMAGJXZRZCPHXIZ-UHFFFAOYSA-N
XLogP3.06
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.20
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

ethyl 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanoate
CID 58244182
ethyl 2-(4-chloronaphthalen-1-yl)oxy-2,2-difluoroacetate
CID 66452638
2-(4-chloronaphthalen-1-yl)oxy-N-methoxyacetamide
CID 27745141
2-(4-chloronaphthalen-1-yl)oxy-N,N-diethylacetamide
CID 112779036
1-chloro-4-methoxynaphthalene
CID 606038
(4-chloronaphthalen-1-yl) 2-methylprop-2-enoate
CID 13195611
2-(4-chloronaphthalen-1-yl)oxyacetate
CID 6995020
2-(4-fluorophenoxy)-2-methylpropanehydrazide
CID 43236623
4-(4-chloronaphthalen-1-yl)oxybutanoic acid
CID 43351513
1-(4-chloronaphthalen-1-yl)-2,2-dimethylpropan-1-one
CID 79601820
2-(4-chloronaphthalen-1-yl)oxy-N-ethylethanamine;hydrochloride
CID 6458435
2-methyl-2-(2,4,6-trifluorophenoxy)propanehydrazide
CID 58243616

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride?
The IUPAC name of 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride (CID 67024400) is 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride.
What is the SMILES notation for 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride?
The canonical SMILES for 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride is CC(C)(Oc1ccc(Cl)c2ccccc12)C(=O)NN.Cl.
What is the InChIKey of 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride?
The InChIKey is MAGJXZRZCPHXIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2.ClH/c1-14(2,13(18)17-16)19-12-8-7-11(15)9-5-3-4-6-10(9)12;/h3-8H,16H2,1-2H3,(H,17,18);1H.
What are the key properties of 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride?
2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride has a molecular weight of 315.20 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloronaphthalen-1-yl)oxy-2-methylpropanehydrazide;hydrochloride is sourced from PubChem (CID 67024400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).