N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine

C13H30N2O2 — CID 59510376

IUPACN-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine
SMILESCCC(C)(C)N(O)CCC(C)(C)N(O)C(C)C
InChIInChI=1S/C13H30N2O2/c1-8-12(4,5)14(16)10-9-13(6,7)15(17)11(2)3/h11,16-17H,8-10H2,1-7H3
InChIKeySTRAQIYLXFDJNH-UHFFFAOYSA-N
MW246.39 g/mol
LogP3.13
Rot. Bonds7

About N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine

N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine (PubChem CID 59510376) has the molecular formula C13H30N2O2 and a molecular weight of 246.39 g/mol. Its IUPAC name is N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine.

Molecular Properties

Compound NameN-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine
PubChem CID59510376
Molecular FormulaC13H30N2O2
Molecular Weight246.39 g/mol
Exact Mass246.23
IUPAC NameN-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine
SMILESCCC(C)(C)N(O)CCC(C)(C)N(O)C(C)C
InChIInChI=1S/C13H30N2O2/c1-8-12(4,5)14(16)10-9-13(6,7)15(17)11(2)3/h11,16-17H,8-10H2,1-7H3
InChIKeySTRAQIYLXFDJNH-UHFFFAOYSA-N
XLogP3.13
TPSA46.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine?
The IUPAC name of N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine (CID 59510376) is N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine.
What is the SMILES notation for N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine?
The canonical SMILES for N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine is CCC(C)(C)N(O)CCC(C)(C)N(O)C(C)C.
What is the InChIKey of N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine?
The InChIKey is STRAQIYLXFDJNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O2/c1-8-12(4,5)14(16)10-9-13(6,7)15(17)11(2)3/h11,16-17H,8-10H2,1-7H3.
What are the key properties of N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine?
N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine has a molecular weight of 246.39 g/mol, XLogP of 3.13, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[hydroxy(2-methylbutan-2-yl)amino]-2-methylbutan-2-yl]-N-propan-2-ylhydroxylamine is sourced from PubChem (CID 59510376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).