N-amino-N',3,3-trimethylbutanimidamide

C7H17N3 — CID 61360849

IUPACN-amino-N',3,3-trimethylbutanimidamide
SMILESC/N=C(/CC(C)(C)C)NN
InChIInChI=1S/C7H17N3/c1-7(2,3)5-6(9-4)10-8/h5,8H2,1-4H3,(H,9,10)
InChIKeyFDJNVXUTLAEXNU-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.91
Rot. Bonds1

About N-amino-N',3,3-trimethylbutanimidamide

N-amino-N',3,3-trimethylbutanimidamide (PubChem CID 61360849) has the molecular formula C7H17N3 and a molecular weight of 143.23 g/mol. Its IUPAC name is N-amino-N',3,3-trimethylbutanimidamide.

Molecular Properties

Compound NameN-amino-N',3,3-trimethylbutanimidamide
PubChem CID61360849
Molecular FormulaC7H17N3
Molecular Weight143.23 g/mol
Exact Mass143.14
IUPAC NameN-amino-N',3,3-trimethylbutanimidamide
SMILESC/N=C(/CC(C)(C)C)NN
InChIInChI=1S/C7H17N3/c1-7(2,3)5-6(9-4)10-8/h5,8H2,1-4H3,(H,9,10)
InChIKeyFDJNVXUTLAEXNU-UHFFFAOYSA-N
XLogP0.91
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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 N-amino-N',3,3-trimethylbutanimidamide?
The IUPAC name of N-amino-N',3,3-trimethylbutanimidamide (CID 61360849) is N-amino-N',3,3-trimethylbutanimidamide.
What is the SMILES notation for N-amino-N',3,3-trimethylbutanimidamide?
The canonical SMILES for N-amino-N',3,3-trimethylbutanimidamide is C/N=C(/CC(C)(C)C)NN.
What is the InChIKey of N-amino-N',3,3-trimethylbutanimidamide?
The InChIKey is FDJNVXUTLAEXNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3/c1-7(2,3)5-6(9-4)10-8/h5,8H2,1-4H3,(H,9,10).
What are the key properties of N-amino-N',3,3-trimethylbutanimidamide?
N-amino-N',3,3-trimethylbutanimidamide has a molecular weight of 143.23 g/mol, XLogP of 0.91, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N',3,3-trimethylbutanimidamide is sourced from PubChem (CID 61360849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).