9,9-dimethyl-6-methylideneundecan-2-amine

C14H29N — CID 18716549

IUPAC9,9-dimethyl-6-methylideneundecan-2-amine
SMILESC=C(CCCC(C)N)CCC(C)(C)CC
InChIInChI=1S/C14H29N/c1-6-14(4,5)11-10-12(2)8-7-9-13(3)15/h13H,2,6-11,15H2,1,3-5H3
InChIKeyTVZOISLPZBDJAM-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.28
Rot. Bonds8

About 9,9-dimethyl-6-methylideneundecan-2-amine

9,9-dimethyl-6-methylideneundecan-2-amine (PubChem CID 18716549) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 9,9-dimethyl-6-methylideneundecan-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-6-methylideneundecan-2-amine
PubChem CID18716549
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name9,9-dimethyl-6-methylideneundecan-2-amine
SMILESC=C(CCCC(C)N)CCC(C)(C)CC
InChIInChI=1S/C14H29N/c1-6-14(4,5)11-10-12(2)8-7-9-13(3)15/h13H,2,6-11,15H2,1,3-5H3
InChIKeyTVZOISLPZBDJAM-UHFFFAOYSA-N
XLogP4.28
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-6-methylideneundecan-2-amine?
The IUPAC name of 9,9-dimethyl-6-methylideneundecan-2-amine (CID 18716549) is 9,9-dimethyl-6-methylideneundecan-2-amine.
What is the SMILES notation for 9,9-dimethyl-6-methylideneundecan-2-amine?
The canonical SMILES for 9,9-dimethyl-6-methylideneundecan-2-amine is C=C(CCCC(C)N)CCC(C)(C)CC.
What is the InChIKey of 9,9-dimethyl-6-methylideneundecan-2-amine?
The InChIKey is TVZOISLPZBDJAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-6-14(4,5)11-10-12(2)8-7-9-13(3)15/h13H,2,6-11,15H2,1,3-5H3.
What are the key properties of 9,9-dimethyl-6-methylideneundecan-2-amine?
9,9-dimethyl-6-methylideneundecan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 4.28, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-6-methylideneundecan-2-amine is sourced from PubChem (CID 18716549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).