6-methyl-2-(5-methylcyclononyl)azonane

C19H37N — CID 146602825

IUPAC6-methyl-2-(5-methylcyclononyl)azonane
SMILESCC1CCCCC(C2CCCC(C)CCCN2)CCC1
InChIInChI=1S/C19H37N/c1-16-8-3-4-12-18(13-5-9-16)19-14-6-10-17(2)11-7-15-20-19/h16-20H,3-15H2,1-2H3
InChIKeyXJODSRFOHVYZEP-UHFFFAOYSA-N
MW279.51 g/mol
LogP5.54
Rot. Bonds1

About 6-methyl-2-(5-methylcyclononyl)azonane

6-methyl-2-(5-methylcyclononyl)azonane (PubChem CID 146602825) has the molecular formula C19H37N and a molecular weight of 279.51 g/mol. Its IUPAC name is 6-methyl-2-(5-methylcyclononyl)azonane.

Molecular Properties

Compound Name6-methyl-2-(5-methylcyclononyl)azonane
PubChem CID146602825
Molecular FormulaC19H37N
Molecular Weight279.51 g/mol
Exact Mass279.29
IUPAC Name6-methyl-2-(5-methylcyclononyl)azonane
SMILESCC1CCCCC(C2CCCC(C)CCCN2)CCC1
InChIInChI=1S/C19H37N/c1-16-8-3-4-12-18(13-5-9-16)19-14-6-10-17(2)11-7-15-20-19/h16-20H,3-15H2,1-2H3
InChIKeyXJODSRFOHVYZEP-UHFFFAOYSA-N
XLogP5.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500279.51
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(5-methylcyclononyl)azonane?
The IUPAC name of 6-methyl-2-(5-methylcyclononyl)azonane (CID 146602825) is 6-methyl-2-(5-methylcyclononyl)azonane.
What is the SMILES notation for 6-methyl-2-(5-methylcyclononyl)azonane?
The canonical SMILES for 6-methyl-2-(5-methylcyclononyl)azonane is CC1CCCCC(C2CCCC(C)CCCN2)CCC1.
What is the InChIKey of 6-methyl-2-(5-methylcyclononyl)azonane?
The InChIKey is XJODSRFOHVYZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37N/c1-16-8-3-4-12-18(13-5-9-16)19-14-6-10-17(2)11-7-15-20-19/h16-20H,3-15H2,1-2H3.
What are the key properties of 6-methyl-2-(5-methylcyclononyl)azonane?
6-methyl-2-(5-methylcyclononyl)azonane has a molecular weight of 279.51 g/mol, XLogP of 5.54, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(5-methylcyclononyl)azonane is sourced from PubChem (CID 146602825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).