(2S)-2-(dimethylamino)butanehydrazide

C6H15N3O — CID 30403559

IUPAC(2S)-2-(dimethylamino)butanehydrazide
SMILESCC[C@@H](C(=O)NN)N(C)C
InChIInChI=1S/C6H15N3O/c1-4-5(9(2)3)6(10)8-7/h5H,4,7H2,1-3H3,(H,8,10)/t5-/m0/s1
InChIKeyOFTBJAWUKMETNT-YFKPBYRVSA-N
MW145.21 g/mol
LogP-0.68
Rot. Bonds3

About (2S)-2-(dimethylamino)butanehydrazide

(2S)-2-(dimethylamino)butanehydrazide (PubChem CID 30403559) has the molecular formula C6H15N3O and a molecular weight of 145.21 g/mol. Its IUPAC name is (2S)-2-(dimethylamino)butanehydrazide.

Molecular Properties

Compound Name(2S)-2-(dimethylamino)butanehydrazide
PubChem CID30403559
Molecular FormulaC6H15N3O
Molecular Weight145.21 g/mol
Exact Mass145.12
IUPAC Name(2S)-2-(dimethylamino)butanehydrazide
SMILESCC[C@@H](C(=O)NN)N(C)C
InChIInChI=1S/C6H15N3O/c1-4-5(9(2)3)6(10)8-7/h5H,4,7H2,1-3H3,(H,8,10)/t5-/m0/s1
InChIKeyOFTBJAWUKMETNT-YFKPBYRVSA-N
XLogP-0.68
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.21
LogP ≤ 5-0.68
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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Related Compounds

2-[cyclopropyl(methyl)amino]butanehydrazide
CID 63573257
2-[bis(2-hydroxyethyl)amino]butanehydrazide
CID 63573033
2-[bis(2-methylpropyl)amino]butanehydrazide
CID 63585587
2-[butan-2-yl(ethyl)amino]butanehydrazide
CID 63571401
methyl 2-(dimethylamino)butanoate
CID 14644900
3-[2-[methyl((113C)methyl)amino](3,4-13C2)butanoylamino]propanoic acid
CID 135251446
ethyl (2S)-2-(dimethylamino)butanoate
CID 51673671
2-[3-(diethylamino)propyl-ethylamino]butanehydrazide
CID 102998207
2-[methyl-(3-methylcyclohexyl)amino]butanehydrazide
CID 63584513
2-[cyclopropyl(2-methylpropyl)amino]butanehydrazide
CID 63584160
2-sulfanylbutanehydrazide
CID 63590292
2-[furan-3-ylmethyl(methyl)amino]butanehydrazide
CID 63584965

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(dimethylamino)butanehydrazide?
The IUPAC name of (2S)-2-(dimethylamino)butanehydrazide (CID 30403559) is (2S)-2-(dimethylamino)butanehydrazide.
What is the SMILES notation for (2S)-2-(dimethylamino)butanehydrazide?
The canonical SMILES for (2S)-2-(dimethylamino)butanehydrazide is CC[C@@H](C(=O)NN)N(C)C.
What is the InChIKey of (2S)-2-(dimethylamino)butanehydrazide?
The InChIKey is OFTBJAWUKMETNT-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H15N3O/c1-4-5(9(2)3)6(10)8-7/h5H,4,7H2,1-3H3,(H,8,10)/t5-/m0/s1.
What are the key properties of (2S)-2-(dimethylamino)butanehydrazide?
(2S)-2-(dimethylamino)butanehydrazide has a molecular weight of 145.21 g/mol, XLogP of -0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(dimethylamino)butanehydrazide is sourced from PubChem (CID 30403559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).