2,2-dimethyldodec-11-en-1-amine

C14H29N — CID 101138270

IUPAC2,2-dimethyldodec-11-en-1-amine
SMILESC=CCCCCCCCCC(C)(C)CN
InChIInChI=1S/C14H29N/c1-4-5-6-7-8-9-10-11-12-14(2,3)13-15/h4H,1,5-13,15H2,2-3H3
InChIKeyABYBPLAKMWEJEB-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.28
Rot. Bonds10

About 2,2-dimethyldodec-11-en-1-amine

2,2-dimethyldodec-11-en-1-amine (PubChem CID 101138270) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 2,2-dimethyldodec-11-en-1-amine.

Molecular Properties

Compound Name2,2-dimethyldodec-11-en-1-amine
PubChem CID101138270
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name2,2-dimethyldodec-11-en-1-amine
SMILESC=CCCCCCCCCC(C)(C)CN
InChIInChI=1S/C14H29N/c1-4-5-6-7-8-9-10-11-12-14(2,3)13-15/h4H,1,5-13,15H2,2-3H3
InChIKeyABYBPLAKMWEJEB-UHFFFAOYSA-N
XLogP4.28
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyldodec-11-en-1-amine?
The IUPAC name of 2,2-dimethyldodec-11-en-1-amine (CID 101138270) is 2,2-dimethyldodec-11-en-1-amine.
What is the SMILES notation for 2,2-dimethyldodec-11-en-1-amine?
The canonical SMILES for 2,2-dimethyldodec-11-en-1-amine is C=CCCCCCCCCC(C)(C)CN.
What is the InChIKey of 2,2-dimethyldodec-11-en-1-amine?
The InChIKey is ABYBPLAKMWEJEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-4-5-6-7-8-9-10-11-12-14(2,3)13-15/h4H,1,5-13,15H2,2-3H3.
What are the key properties of 2,2-dimethyldodec-11-en-1-amine?
2,2-dimethyldodec-11-en-1-amine has a molecular weight of 211.39 g/mol, XLogP of 4.28, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyldodec-11-en-1-amine is sourced from PubChem (CID 101138270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).