2-(tert-butylamino)-N'-hydroxyethanimidamide

C6H15N3O — CID 60718842

IUPAC2-(tert-butylamino)-N'-hydroxyethanimidamide
SMILESCC(C)(C)NC/C(N)=N/O
InChIInChI=1S/C6H15N3O/c1-6(2,3)8-4-5(7)9-10/h8,10H,4H2,1-3H3,(H2,7,9)
InChIKeyFXRWAOSXSANXQT-UHFFFAOYSA-N
MW145.21 g/mol
LogP0.12
Rot. Bonds2

About 2-(tert-butylamino)-N'-hydroxyethanimidamide

2-(tert-butylamino)-N'-hydroxyethanimidamide (PubChem CID 60718842) has the molecular formula C6H15N3O and a molecular weight of 145.21 g/mol. Its IUPAC name is 2-(tert-butylamino)-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N'-hydroxyethanimidamide
PubChem CID60718842
Molecular FormulaC6H15N3O
Molecular Weight145.21 g/mol
Exact Mass145.12
IUPAC Name2-(tert-butylamino)-N'-hydroxyethanimidamide
SMILESCC(C)(C)NC/C(N)=N/O
InChIInChI=1S/C6H15N3O/c1-6(2,3)8-4-5(7)9-10/h8,10H,4H2,1-3H3,(H2,7,9)
InChIKeyFXRWAOSXSANXQT-UHFFFAOYSA-N
XLogP0.12
TPSA70.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.21
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(tert-butylamino)-N'-hydroxyethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-tert-butyl-2-(tert-butylamino)ethanimidamide
CID 59404200
1-N',3-N'-dihydroxypropanediimidamide
CID 59593648
N'-hydroxy-2-(propylamino)ethanimidamide
CID 60711995
bis(1-N',3-N'-dihydroxypropanediimidamide);nickel
CID 5259453
N'-hydroxy-2-(4-methylanilino)ethanimidamide
CID 20542821
N'-hydroxy-4-(3-methylpentan-3-ylamino)butanimidamide
CID 106329372
2-[[(2Z)-2-amino-2-hydroxyiminoethyl]amino]-N'-hydroxyethanimidamide;2-(cyanomethylamino)acetonitrile
CID 157354439
2-[(2-amino-2-hydroxyiminoethyl)amino]acetamide
CID 77027895
azanide;tris(1-N',3-N'-dihydroxypropanediimidamide);nickel
CID 5259455
1,3-bis(tert-butylamino)propan-2-one;hydrochloride
CID 88754733
tert-butyl 3-amino-3-hydroxyiminopropanoate
CID 76589802
N'-hydroxy-2-(2-methylanilino)ethanimidamide
CID 54379643

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N'-hydroxyethanimidamide?
The IUPAC name of 2-(tert-butylamino)-N'-hydroxyethanimidamide (CID 60718842) is 2-(tert-butylamino)-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-(tert-butylamino)-N'-hydroxyethanimidamide?
The canonical SMILES for 2-(tert-butylamino)-N'-hydroxyethanimidamide is CC(C)(C)NC/C(N)=N/O.
What is the InChIKey of 2-(tert-butylamino)-N'-hydroxyethanimidamide?
The InChIKey is FXRWAOSXSANXQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O/c1-6(2,3)8-4-5(7)9-10/h8,10H,4H2,1-3H3,(H2,7,9).
What are the key properties of 2-(tert-butylamino)-N'-hydroxyethanimidamide?
2-(tert-butylamino)-N'-hydroxyethanimidamide has a molecular weight of 145.21 g/mol, XLogP of 0.12, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N'-hydroxyethanimidamide is sourced from PubChem (CID 60718842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).