(2R)-2-methyl-4-oxopentanehydrazide

C6H12N2O2 — CID 166884818

IUPAC(2R)-2-methyl-4-oxopentanehydrazide
SMILESCC(=O)C[C@@H](C)C(=O)NN
InChIInChI=1S/C6H12N2O2/c1-4(3-5(2)9)6(10)8-7/h4H,3,7H2,1-2H3,(H,8,10)/t4-/m1/s1
InChIKeyIMUQQELSJVOBAO-SCSAIBSYSA-N
MW144.17 g/mol
LogP-0.41
Rot. Bonds3

About (2R)-2-methyl-4-oxopentanehydrazide

(2R)-2-methyl-4-oxopentanehydrazide (PubChem CID 166884818) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is (2R)-2-methyl-4-oxopentanehydrazide.

Molecular Properties

Compound Name(2R)-2-methyl-4-oxopentanehydrazide
PubChem CID166884818
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name(2R)-2-methyl-4-oxopentanehydrazide
SMILESCC(=O)C[C@@H](C)C(=O)NN
InChIInChI=1S/C6H12N2O2/c1-4(3-5(2)9)6(10)8-7/h4H,3,7H2,1-2H3,(H,8,10)/t4-/m1/s1
InChIKeyIMUQQELSJVOBAO-SCSAIBSYSA-N
XLogP-0.41
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.41
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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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-4-oxopentanehydrazide?
The IUPAC name of (2R)-2-methyl-4-oxopentanehydrazide (CID 166884818) is (2R)-2-methyl-4-oxopentanehydrazide.
What is the SMILES notation for (2R)-2-methyl-4-oxopentanehydrazide?
The canonical SMILES for (2R)-2-methyl-4-oxopentanehydrazide is CC(=O)C[C@@H](C)C(=O)NN.
What is the InChIKey of (2R)-2-methyl-4-oxopentanehydrazide?
The InChIKey is IMUQQELSJVOBAO-SCSAIBSYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-4(3-5(2)9)6(10)8-7/h4H,3,7H2,1-2H3,(H,8,10)/t4-/m1/s1.
What are the key properties of (2R)-2-methyl-4-oxopentanehydrazide?
(2R)-2-methyl-4-oxopentanehydrazide has a molecular weight of 144.17 g/mol, XLogP of -0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-4-oxopentanehydrazide is sourced from PubChem (CID 166884818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).