N'-ethyl-N',2-dimethylbutanehydrazide

C8H18N2O — CID 131211821

IUPACN'-ethyl-N',2-dimethylbutanehydrazide
SMILESCCC(C)C(=O)NN(C)CC
InChIInChI=1S/C8H18N2O/c1-5-7(3)8(11)9-10(4)6-2/h7H,5-6H2,1-4H3,(H,9,11)
InChIKeyHXMAQOVMFGMJSB-UHFFFAOYSA-N
MW158.24 g/mol
LogP1.02
Rot. Bonds4

About N'-ethyl-N',2-dimethylbutanehydrazide

N'-ethyl-N',2-dimethylbutanehydrazide (PubChem CID 131211821) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is N'-ethyl-N',2-dimethylbutanehydrazide.

Molecular Properties

Compound NameN'-ethyl-N',2-dimethylbutanehydrazide
PubChem CID131211821
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC NameN'-ethyl-N',2-dimethylbutanehydrazide
SMILESCCC(C)C(=O)NN(C)CC
InChIInChI=1S/C8H18N2O/c1-5-7(3)8(11)9-10(4)6-2/h7H,5-6H2,1-4H3,(H,9,11)
InChIKeyHXMAQOVMFGMJSB-UHFFFAOYSA-N
XLogP1.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[ethyl(methyl)amino]ethyl]-2-methylbutanamide
CID 20730110
N-ethyl-N,2-dimethylbutanamide
CID 89343843
(2S,3S)-2-amino-N',N',3-trimethylpentanehydrazide
CID 83021185
N,2-dimethyl-N-propylbutanamide
CID 89368936
N-[(2R)-butan-2-yl]-2-methylbutanamide
CID 88542995
ethane;N-ethyl-2-methylbutanamide
CID 145471862
N-acetyl-2-methylbutanamide
CID 59565834
2-methylbutanoylcarbamic acid
CID 87928192
(2R)-N-hydroxy-N,2-dimethylbutanamide
CID 171076136
(2S)-N,N-diethyl-2-methylbutanamide
CID 158106259
N'-ethyl-N'-methyl-2-methylsulfanylacetohydrazide
CID 131019040
2-methyl-N-methylsulfonylbutanamide
CID 18336288

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N',2-dimethylbutanehydrazide?
The IUPAC name of N'-ethyl-N',2-dimethylbutanehydrazide (CID 131211821) is N'-ethyl-N',2-dimethylbutanehydrazide.
What is the SMILES notation for N'-ethyl-N',2-dimethylbutanehydrazide?
The canonical SMILES for N'-ethyl-N',2-dimethylbutanehydrazide is CCC(C)C(=O)NN(C)CC.
What is the InChIKey of N'-ethyl-N',2-dimethylbutanehydrazide?
The InChIKey is HXMAQOVMFGMJSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-5-7(3)8(11)9-10(4)6-2/h7H,5-6H2,1-4H3,(H,9,11).
What are the key properties of N'-ethyl-N',2-dimethylbutanehydrazide?
N'-ethyl-N',2-dimethylbutanehydrazide has a molecular weight of 158.24 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N',2-dimethylbutanehydrazide is sourced from PubChem (CID 131211821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).