5,5-dimethylnonane;bis(2-methylpropan-2-amine)

C19H46N2 — CID 159841481

IUPAC5,5-dimethylnonane;bis(2-methylpropan-2-amine)
SMILESCC(C)(C)N.CC(C)(C)N.CCCCC(C)(C)CCCC
InChIInChI=1S/C11H24.2C4H11N/c1-5-7-9-11(3,4)10-8-6-2;2*1-4(2,3)5/h5-10H2,1-4H3;2*5H2,1-3H3
InChIKeyNOSQCLWLUXZBRZ-UHFFFAOYSA-N
MW302.59 g/mol
LogP5.88
Rot. Bonds6

About 5,5-dimethylnonane;bis(2-methylpropan-2-amine)

5,5-dimethylnonane;bis(2-methylpropan-2-amine) (PubChem CID 159841481) has the molecular formula C19H46N2 and a molecular weight of 302.59 g/mol. Its IUPAC name is 5,5-dimethylnonane;bis(2-methylpropan-2-amine).

Molecular Properties

Compound Name5,5-dimethylnonane;bis(2-methylpropan-2-amine)
PubChem CID159841481
Molecular FormulaC19H46N2
Molecular Weight302.59 g/mol
Exact Mass302.37
IUPAC Name5,5-dimethylnonane;bis(2-methylpropan-2-amine)
SMILESCC(C)(C)N.CC(C)(C)N.CCCCC(C)(C)CCCC
InChIInChI=1S/C11H24.2C4H11N/c1-5-7-9-11(3,4)10-8-6-2;2*1-4(2,3)5/h5-10H2,1-4H3;2*5H2,1-3H3
InChIKeyNOSQCLWLUXZBRZ-UHFFFAOYSA-N
XLogP5.88
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.59
LogP ≤ 55.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethylnonane;bis(2-methylpropan-2-amine)?
The IUPAC name of 5,5-dimethylnonane;bis(2-methylpropan-2-amine) (CID 159841481) is 5,5-dimethylnonane;bis(2-methylpropan-2-amine).
What is the SMILES notation for 5,5-dimethylnonane;bis(2-methylpropan-2-amine)?
The canonical SMILES for 5,5-dimethylnonane;bis(2-methylpropan-2-amine) is CC(C)(C)N.CC(C)(C)N.CCCCC(C)(C)CCCC.
What is the InChIKey of 5,5-dimethylnonane;bis(2-methylpropan-2-amine)?
The InChIKey is NOSQCLWLUXZBRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24.2C4H11N/c1-5-7-9-11(3,4)10-8-6-2;2*1-4(2,3)5/h5-10H2,1-4H3;2*5H2,1-3H3.
What are the key properties of 5,5-dimethylnonane;bis(2-methylpropan-2-amine)?
5,5-dimethylnonane;bis(2-methylpropan-2-amine) has a molecular weight of 302.59 g/mol, XLogP of 5.88, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethylnonane;bis(2-methylpropan-2-amine) is sourced from PubChem (CID 159841481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).