2-(3-methoxy-3-methylbutoxy)butanimidamide

C10H22N2O2 — CID 106665863

IUPAC2-(3-methoxy-3-methylbutoxy)butanimidamide
SMILES[H]/N=C(\N)C(CC)OCCC(C)(C)OC
InChIInChI=1S/C10H22N2O2/c1-5-8(9(11)12)14-7-6-10(2,3)13-4/h8H,5-7H2,1-4H3,(H3,11,12)
InChIKeyIVBXQXOHDLHGOT-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.53
Rot. Bonds7

About 2-(3-methoxy-3-methylbutoxy)butanimidamide

2-(3-methoxy-3-methylbutoxy)butanimidamide (PubChem CID 106665863) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-(3-methoxy-3-methylbutoxy)butanimidamide.

Molecular Properties

Compound Name2-(3-methoxy-3-methylbutoxy)butanimidamide
PubChem CID106665863
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name2-(3-methoxy-3-methylbutoxy)butanimidamide
SMILES[H]/N=C(\N)C(CC)OCCC(C)(C)OC
InChIInChI=1S/C10H22N2O2/c1-5-8(9(11)12)14-7-6-10(2,3)13-4/h8H,5-7H2,1-4H3,(H3,11,12)
InChIKeyIVBXQXOHDLHGOT-UHFFFAOYSA-N
XLogP1.53
TPSA68.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-[2-(2-methylpropoxy)ethoxy]butanimidamide
CID 106447826
3-amino-2-(3-methoxy-3-methylbutoxy)propanoic acid
CID 106668506
3-[(3-methoxy-3-methylbutyl)-methylamino]-2-methylpropanimidamide
CID 103033932
3-(3-methoxy-3-methylbutoxy)heptan-4-ol
CID 106666571
ethyl 2-fluoro-2-(3-methoxy-3-methylbutoxy)acetate
CID 106664712
4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide
CID 106666691
3-(3-methoxy-3-methylbutoxy)butan-2-one
CID 58421308
3-(3-methoxy-3-methylbutoxy)-N-methylbutan-2-amine
CID 106665253
2-(3-methoxy-3-methylbutoxy)benzenecarboximidamide
CID 103033946
(3-methoxy-3-methylbutyl) 2-(methylamino)butanoate
CID 106666081
ethyl 2-(3,3-dimethylbutoxy)butanoate
CID 66232205
2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]butanimidamide
CID 63524867

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-3-methylbutoxy)butanimidamide?
The IUPAC name of 2-(3-methoxy-3-methylbutoxy)butanimidamide (CID 106665863) is 2-(3-methoxy-3-methylbutoxy)butanimidamide.
What is the SMILES notation for 2-(3-methoxy-3-methylbutoxy)butanimidamide?
The canonical SMILES for 2-(3-methoxy-3-methylbutoxy)butanimidamide is [H]/N=C(\N)C(CC)OCCC(C)(C)OC.
What is the InChIKey of 2-(3-methoxy-3-methylbutoxy)butanimidamide?
The InChIKey is IVBXQXOHDLHGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-5-8(9(11)12)14-7-6-10(2,3)13-4/h8H,5-7H2,1-4H3,(H3,11,12).
What are the key properties of 2-(3-methoxy-3-methylbutoxy)butanimidamide?
2-(3-methoxy-3-methylbutoxy)butanimidamide has a molecular weight of 202.30 g/mol, XLogP of 1.53, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-3-methylbutoxy)butanimidamide is sourced from PubChem (CID 106665863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).