3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide

C11H25N3O — CID 63579651

IUPAC3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide
SMILESCC(C)CN(C(C)C)C(C)CC(=O)NN
InChIInChI=1S/C11H25N3O/c1-8(2)7-14(9(3)4)10(5)6-11(15)13-12/h8-10H,6-7,12H2,1-5H3,(H,13,15)
InChIKeyWOORGQIGGQHFNH-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.12
Rot. Bonds6

About 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide

3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide (PubChem CID 63579651) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide.

Molecular Properties

Compound Name3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide
PubChem CID63579651
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC Name3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide
SMILESCC(C)CN(C(C)C)C(C)CC(=O)NN
InChIInChI=1S/C11H25N3O/c1-8(2)7-14(9(3)4)10(5)6-11(15)13-12/h8-10H,6-7,12H2,1-5H3,(H,13,15)
InChIKeyWOORGQIGGQHFNH-UHFFFAOYSA-N
XLogP1.12
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.12
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

3-[bis(2-methylpropyl)amino]butanehydrazide
CID 63583922
3-[bis(3-methylbutyl)amino]butanehydrazide
CID 114011284
3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]butanehydrazide
CID 55213672
2-[ethyl(2-methylpropyl)amino]acetohydrazide
CID 63574008
4-amino-N-methyl-3-[2-methylpropyl(propan-2-yl)amino]butanamide
CID 66429259
3-[2,2-dimethylpropyl(methyl)amino]butanehydrazide
CID 63578194
2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]-N,N-dimethylacetamide
CID 63573657
N-(2-methylpropyl)-N-propan-2-ylbutan-2-amine
CID 139772547
3-phosphanylbutanehydrazide
CID 163485274
3-[1-methoxypropan-2-yl(methyl)amino]butanehydrazide
CID 63583760
4-amino-N,N-diethyl-3-[2-methylpropyl(propan-2-yl)amino]butanamide
CID 66431686
N-ethyl-2-[ethyl-(4-hydrazinyl-4-oxobutan-2-yl)amino]acetamide
CID 63577879

Frequently Asked Questions

What is the IUPAC name of 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide?
The IUPAC name of 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide (CID 63579651) is 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide.
What is the SMILES notation for 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide?
The canonical SMILES for 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide is CC(C)CN(C(C)C)C(C)CC(=O)NN.
What is the InChIKey of 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide?
The InChIKey is WOORGQIGGQHFNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-8(2)7-14(9(3)4)10(5)6-11(15)13-12/h8-10H,6-7,12H2,1-5H3,(H,13,15).
What are the key properties of 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide?
3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide has a molecular weight of 215.34 g/mol, XLogP of 1.12, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-methylpropyl(propan-2-yl)amino]butanehydrazide is sourced from PubChem (CID 63579651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).