cyclononane;methane;2-methylpropan-2-amine

C14H33N — CID 158652044

IUPACcyclononane;methane;2-methylpropan-2-amine
SMILESC.C1CCCCCCCC1.CC(C)(C)N
InChIInChI=1S/C9H18.C4H11N.CH4/c1-2-4-6-8-9-7-5-3-1;1-4(2,3)5;/h1-9H2;5H2,1-3H3;1H4
InChIKeyIBRFMMNJWNKVCT-UHFFFAOYSA-N
MW215.42 g/mol
LogP4.89
Rot. Bonds

About cyclononane;methane;2-methylpropan-2-amine

cyclononane;methane;2-methylpropan-2-amine (PubChem CID 158652044) has the molecular formula C14H33N and a molecular weight of 215.42 g/mol. Its IUPAC name is cyclononane;methane;2-methylpropan-2-amine.

Molecular Properties

Compound Namecyclononane;methane;2-methylpropan-2-amine
PubChem CID158652044
Molecular FormulaC14H33N
Molecular Weight215.42 g/mol
Exact Mass215.26
IUPAC Namecyclononane;methane;2-methylpropan-2-amine
SMILESC.C1CCCCCCCC1.CC(C)(C)N
InChIInChI=1S/C9H18.C4H11N.CH4/c1-2-4-6-8-9-7-5-3-1;1-4(2,3)5;/h1-9H2;5H2,1-3H3;1H4
InChIKeyIBRFMMNJWNKVCT-UHFFFAOYSA-N
XLogP4.89
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.42
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

CID 175795972
CID 175795972
tetrakis(2,2-dimethylpropane);bis(2-methylpropan-2-amine)
CID 159299187
bis(2-methylpropan-2-amine);dihydrochloride
CID 175186319
ethane;2-methylpropan-2-amine
CID 142052554
2-methylpropan-2-amine;pyrrolidine
CID 167503622
magnesium;2-methylpropan-2-amine;dibromide
CID 175491555
cyclohexane;cyclopentane;ethane;methane
CID 161306107
cyclobutane;ethane;methane
CID 159400168
cyclohexane;methanamine
CID 18619744
cyclobutane;ethane;methane
CID 161109968
cycloheptane;methane
CID 160881115
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CID 159769101

Frequently Asked Questions

What is the IUPAC name of cyclononane;methane;2-methylpropan-2-amine?
The IUPAC name of cyclononane;methane;2-methylpropan-2-amine (CID 158652044) is cyclononane;methane;2-methylpropan-2-amine.
What is the SMILES notation for cyclononane;methane;2-methylpropan-2-amine?
The canonical SMILES for cyclononane;methane;2-methylpropan-2-amine is C.C1CCCCCCCC1.CC(C)(C)N.
What is the InChIKey of cyclononane;methane;2-methylpropan-2-amine?
The InChIKey is IBRFMMNJWNKVCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18.C4H11N.CH4/c1-2-4-6-8-9-7-5-3-1;1-4(2,3)5;/h1-9H2;5H2,1-3H3;1H4.
What are the key properties of cyclononane;methane;2-methylpropan-2-amine?
cyclononane;methane;2-methylpropan-2-amine has a molecular weight of 215.42 g/mol, XLogP of 4.89, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclononane;methane;2-methylpropan-2-amine is sourced from PubChem (CID 158652044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).