7-ethyl-N,2-dimethylundecan-6-amine

C15H33N — CID 105028702

IUPAC7-ethyl-N,2-dimethylundecan-6-amine
SMILESCCCCC(CC)C(CCCC(C)C)NC
InChIInChI=1S/C15H33N/c1-6-8-11-14(7-2)15(16-5)12-9-10-13(3)4/h13-16H,6-12H2,1-5H3
InChIKeyBOJNLKCZLFZVGH-UHFFFAOYSA-N
MW227.44 g/mol
LogP4.62
Rot. Bonds10

About 7-ethyl-N,2-dimethylundecan-6-amine

7-ethyl-N,2-dimethylundecan-6-amine (PubChem CID 105028702) has the molecular formula C15H33N and a molecular weight of 227.44 g/mol. Its IUPAC name is 7-ethyl-N,2-dimethylundecan-6-amine.

Molecular Properties

Compound Name7-ethyl-N,2-dimethylundecan-6-amine
PubChem CID105028702
Molecular FormulaC15H33N
Molecular Weight227.44 g/mol
Exact Mass227.26
IUPAC Name7-ethyl-N,2-dimethylundecan-6-amine
SMILESCCCCC(CC)C(CCCC(C)C)NC
InChIInChI=1S/C15H33N/c1-6-8-11-14(7-2)15(16-5)12-9-10-13(3)4/h13-16H,6-12H2,1-5H3
InChIKeyBOJNLKCZLFZVGH-UHFFFAOYSA-N
XLogP4.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.44
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-N,2-dimethylundecan-6-amine?
The IUPAC name of 7-ethyl-N,2-dimethylundecan-6-amine (CID 105028702) is 7-ethyl-N,2-dimethylundecan-6-amine.
What is the SMILES notation for 7-ethyl-N,2-dimethylundecan-6-amine?
The canonical SMILES for 7-ethyl-N,2-dimethylundecan-6-amine is CCCCC(CC)C(CCCC(C)C)NC.
What is the InChIKey of 7-ethyl-N,2-dimethylundecan-6-amine?
The InChIKey is BOJNLKCZLFZVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N/c1-6-8-11-14(7-2)15(16-5)12-9-10-13(3)4/h13-16H,6-12H2,1-5H3.
What are the key properties of 7-ethyl-N,2-dimethylundecan-6-amine?
7-ethyl-N,2-dimethylundecan-6-amine has a molecular weight of 227.44 g/mol, XLogP of 4.62, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-N,2-dimethylundecan-6-amine is sourced from PubChem (CID 105028702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).