4-cyclohexyl-N-methylbutanehydrazide

C11H22N2O — CID 116845177

IUPAC4-cyclohexyl-N-methylbutanehydrazide
SMILESCN(N)C(=O)CCCC1CCCCC1
InChIInChI=1S/C11H22N2O/c1-13(12)11(14)9-5-8-10-6-3-2-4-7-10/h10H,2-9,12H2,1H3
InChIKeyYJTNKSMOFDILJN-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.07
Rot. Bonds4

About 4-cyclohexyl-N-methylbutanehydrazide

4-cyclohexyl-N-methylbutanehydrazide (PubChem CID 116845177) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-cyclohexyl-N-methylbutanehydrazide.

Molecular Properties

Compound Name4-cyclohexyl-N-methylbutanehydrazide
PubChem CID116845177
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name4-cyclohexyl-N-methylbutanehydrazide
SMILESCN(N)C(=O)CCCC1CCCCC1
InChIInChI=1S/C11H22N2O/c1-13(12)11(14)9-5-8-10-6-3-2-4-7-10/h10H,2-9,12H2,1H3
InChIKeyYJTNKSMOFDILJN-UHFFFAOYSA-N
XLogP2.07
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.07
H-Bond Donors ≤ 51
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

4-cyclopentyl-N-methylbutanehydrazide
CID 116845176
N-butan-2-yl-4-cyclohexyl-N-methylbutanamide
CID 112817760
N-methyl-4-(1-methylpyrrolidin-3-yl)butanehydrazide
CID 116845186
4-cyclohexyl-N-(5-hydroxypentyl)-N-methylbutanamide
CID 107202086
4-cyclohexyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylbutanamide
CID 115759935
5-cyclopentylpentan-2-one
CID 18433881
5-[3-cyclohexylpropyl(methyl)amino]-5-oxopentanoic acid
CID 67699840
4-cyclohexylbutanoyl cyanide
CID 15712809
N-(2-cyclohexylethyl)-4-hydroxy-N-methylbutanamide
CID 115163166
2-[4-cyclohexylbutanoyl(cyclopentyl)amino]acetic acid
CID 60825422
4-cyclohexylbutanoic acid;λ2-plumbane
CID 173062750
CID 131865884
CID 131865884

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-methylbutanehydrazide?
The IUPAC name of 4-cyclohexyl-N-methylbutanehydrazide (CID 116845177) is 4-cyclohexyl-N-methylbutanehydrazide.
What is the SMILES notation for 4-cyclohexyl-N-methylbutanehydrazide?
The canonical SMILES for 4-cyclohexyl-N-methylbutanehydrazide is CN(N)C(=O)CCCC1CCCCC1.
What is the InChIKey of 4-cyclohexyl-N-methylbutanehydrazide?
The InChIKey is YJTNKSMOFDILJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-13(12)11(14)9-5-8-10-6-3-2-4-7-10/h10H,2-9,12H2,1H3.
What are the key properties of 4-cyclohexyl-N-methylbutanehydrazide?
4-cyclohexyl-N-methylbutanehydrazide has a molecular weight of 198.31 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-methylbutanehydrazide is sourced from PubChem (CID 116845177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).