N'-butyl-3-hydroxynaphthalene-2-carbohydrazide

C15H18N2O2 — CID 118418396

IUPACN'-butyl-3-hydroxynaphthalene-2-carbohydrazide
SMILESCCCCNNC(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C15H18N2O2/c1-2-3-8-16-17-15(19)13-9-11-6-4-5-7-12(11)10-14(13)18/h4-7,9-10,16,18H,2-3,8H2,1H3,(H,17,19)
InChIKeyHDCTYQNICGZJEH-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.58
Rot. Bonds5

About N'-butyl-3-hydroxynaphthalene-2-carbohydrazide

N'-butyl-3-hydroxynaphthalene-2-carbohydrazide (PubChem CID 118418396) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N'-butyl-3-hydroxynaphthalene-2-carbohydrazide.

Molecular Properties

Compound NameN'-butyl-3-hydroxynaphthalene-2-carbohydrazide
PubChem CID118418396
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN'-butyl-3-hydroxynaphthalene-2-carbohydrazide
SMILESCCCCNNC(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C15H18N2O2/c1-2-3-8-16-17-15(19)13-9-11-6-4-5-7-12(11)10-14(13)18/h4-7,9-10,16,18H,2-3,8H2,1H3,(H,17,19)
InChIKeyHDCTYQNICGZJEH-UHFFFAOYSA-N
XLogP2.58
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-hydroxy-N-[6-[(3-hydroxynaphthalene-2-carbonyl)amino]hexyl]naphthalene-2-carboxamide
CID 3119117
2-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamoyl]benzoic acid
CID 969323
3-hydroxy-N-(2-methylbutan-2-yl)naphthalene-2-carboxamide
CID 43403898
3-hydroxy-N-[(E)-2-methylidenehexylideneamino]naphthalene-2-carboxamide
CID 6906295
3-hydroxy-N-(2-methylsulfanylethyl)naphthalene-2-carboxamide
CID 60629996
3-hydroxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide
CID 806093
3-hydroxy-N-(5-methylhexyl)naphthalene-2-carboxamide
CID 115325898
N-(2,2-dimethylpropyl)-3-hydroxynaphthalene-2-carboxamide
CID 61166883
4-[2-(3-hydroxynaphthalene-2-carbonyl)hydrazinyl]-4-oxobutanoate
CID 7034789
3-hydroxynaphthalene-2-carbohydrazide;sulfuric acid
CID 160733684
1-(4-ethylphenyl)-3-[(3-hydroxynaphthalene-2-carbonyl)amino]thiourea
CID 7988148
3-hydroxynaphthalene-2-carboxylic acid;octanamide
CID 22901759

Frequently Asked Questions

What is the IUPAC name of N'-butyl-3-hydroxynaphthalene-2-carbohydrazide?
The IUPAC name of N'-butyl-3-hydroxynaphthalene-2-carbohydrazide (CID 118418396) is N'-butyl-3-hydroxynaphthalene-2-carbohydrazide.
What is the SMILES notation for N'-butyl-3-hydroxynaphthalene-2-carbohydrazide?
The canonical SMILES for N'-butyl-3-hydroxynaphthalene-2-carbohydrazide is CCCCNNC(=O)c1cc2ccccc2cc1O.
What is the InChIKey of N'-butyl-3-hydroxynaphthalene-2-carbohydrazide?
The InChIKey is HDCTYQNICGZJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-2-3-8-16-17-15(19)13-9-11-6-4-5-7-12(11)10-14(13)18/h4-7,9-10,16,18H,2-3,8H2,1H3,(H,17,19).
What are the key properties of N'-butyl-3-hydroxynaphthalene-2-carbohydrazide?
N'-butyl-3-hydroxynaphthalene-2-carbohydrazide has a molecular weight of 258.32 g/mol, XLogP of 2.58, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-butyl-3-hydroxynaphthalene-2-carbohydrazide is sourced from PubChem (CID 118418396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).