N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid

C12H22N2O5 — CID 24832423

IUPACN'-(1-cyclohexylethyl)acetohydrazide;oxalic acid
SMILESCC(=O)NNC(C)C1CCCCC1.O=C(O)C(=O)O
InChIInChI=1S/C10H20N2O.C2H2O4/c1-8(11-12-9(2)13)10-6-4-3-5-7-10;3-1(4)2(5)6/h8,10-11H,3-7H2,1-2H3,(H,12,13);(H,3,4)(H,5,6)
InChIKeyJWKWRIHQZIIEIM-UHFFFAOYSA-N
MW274.32 g/mol
LogP0.75
Rot. Bonds3

About N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid

N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid (PubChem CID 24832423) has the molecular formula C12H22N2O5 and a molecular weight of 274.32 g/mol. Its IUPAC name is N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid.

Molecular Properties

Compound NameN'-(1-cyclohexylethyl)acetohydrazide;oxalic acid
PubChem CID24832423
Molecular FormulaC12H22N2O5
Molecular Weight274.32 g/mol
Exact Mass274.15
IUPAC NameN'-(1-cyclohexylethyl)acetohydrazide;oxalic acid
SMILESCC(=O)NNC(C)C1CCCCC1.O=C(O)C(=O)O
InChIInChI=1S/C10H20N2O.C2H2O4/c1-8(11-12-9(2)13)10-6-4-3-5-7-10;3-1(4)2(5)6/h8,10-11H,3-7H2,1-2H3,(H,12,13);(H,3,4)(H,5,6)
InChIKeyJWKWRIHQZIIEIM-UHFFFAOYSA-N
XLogP0.75
TPSA115.73 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 50.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(1S)-1-cyclopentylethyl]acetamide
CID 81388909
N-(1-cyclobutylethyl)acetamide
CID 115769098
N-(1-cyclopentylethyl)hydroxylamine
CID 82687536
2-(1-cyclobutylethylamino)-2-oxoacetic acid
CID 104768741
2-(1-cyclopropylethylamino)-2-oxoacetic acid
CID 43533725
3-cyclohexyl-2-oxobutanoic acid
CID 13391916
2,3-bis(1-cyclohexylethyl)but-2-enedioic acid
CID 67547723
(E)-3-[[(1S)-1-cyclohexylethyl]amino]prop-2-enoic acid
CID 103257529
3-[[(1R)-1-cyclohexylethyl]amino]butanoic acid
CID 81385050
N,N'-bis[(1S)-1-cyclohexylethyl]butanediamide
CID 132596983
1-cyclohexyl-N-(1-cyclopentylethyl)ethanamine
CID 62633016
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177

Frequently Asked Questions

What is the IUPAC name of N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid?
The IUPAC name of N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid (CID 24832423) is N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid.
What is the SMILES notation for N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid?
The canonical SMILES for N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid is CC(=O)NNC(C)C1CCCCC1.O=C(O)C(=O)O.
What is the InChIKey of N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid?
The InChIKey is JWKWRIHQZIIEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O.C2H2O4/c1-8(11-12-9(2)13)10-6-4-3-5-7-10;3-1(4)2(5)6/h8,10-11H,3-7H2,1-2H3,(H,12,13);(H,3,4)(H,5,6).
What are the key properties of N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid?
N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid has a molecular weight of 274.32 g/mol, XLogP of 0.75, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-cyclohexylethyl)acetohydrazide;oxalic acid is sourced from PubChem (CID 24832423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).