2-ethyl-N,2-dimethylundecan-1-amine

C15H33N — CID 63508847

IUPAC2-ethyl-N,2-dimethylundecan-1-amine
SMILESCCCCCCCCCC(C)(CC)CNC
InChIInChI=1S/C15H33N/c1-5-7-8-9-10-11-12-13-15(3,6-2)14-16-4/h16H,5-14H2,1-4H3
InChIKeyPNILXDGDHJRICZ-UHFFFAOYSA-N
MW227.44 g/mol
LogP4.76
Rot. Bonds11

About 2-ethyl-N,2-dimethylundecan-1-amine

2-ethyl-N,2-dimethylundecan-1-amine (PubChem CID 63508847) has the molecular formula C15H33N and a molecular weight of 227.44 g/mol. Its IUPAC name is 2-ethyl-N,2-dimethylundecan-1-amine.

Molecular Properties

Compound Name2-ethyl-N,2-dimethylundecan-1-amine
PubChem CID63508847
Molecular FormulaC15H33N
Molecular Weight227.44 g/mol
Exact Mass227.26
IUPAC Name2-ethyl-N,2-dimethylundecan-1-amine
SMILESCCCCCCCCCC(C)(CC)CNC
InChIInChI=1S/C15H33N/c1-5-7-8-9-10-11-12-13-15(3,6-2)14-16-4/h16H,5-14H2,1-4H3
InChIKeyPNILXDGDHJRICZ-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.44
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-ethyl-3-methyltetradecane
CID 54159558
3-ethyl-3-methyldecane
CID 545661
3-ethyl-3-methyldodecane
CID 56619966
5-ethyl-5-methylundecane
CID 57491570
5-ethyl-5-methylhenicosane
CID 86034991
5-ethyl-5-methylhentetracontane
CID 123896152
N-tert-butyl-2-ethyl-2-methylheptan-1-amine
CID 63508148
N,2,2-trimethyloctan-1-amine
CID 62723717
11-methyl-11-nonylhenicosane
CID 19690388
13-methyl-13-octylhentriacontane
CID 173152457
4-[2-(2-butoxyethoxy)ethoxy]-2-ethyl-N,2-dimethylbutan-1-amine
CID 104566582
2-ethyl-N,N',2-trimethylbutane-1,4-diamine
CID 148591488

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,2-dimethylundecan-1-amine?
The IUPAC name of 2-ethyl-N,2-dimethylundecan-1-amine (CID 63508847) is 2-ethyl-N,2-dimethylundecan-1-amine.
What is the SMILES notation for 2-ethyl-N,2-dimethylundecan-1-amine?
The canonical SMILES for 2-ethyl-N,2-dimethylundecan-1-amine is CCCCCCCCCC(C)(CC)CNC.
What is the InChIKey of 2-ethyl-N,2-dimethylundecan-1-amine?
The InChIKey is PNILXDGDHJRICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N/c1-5-7-8-9-10-11-12-13-15(3,6-2)14-16-4/h16H,5-14H2,1-4H3.
What are the key properties of 2-ethyl-N,2-dimethylundecan-1-amine?
2-ethyl-N,2-dimethylundecan-1-amine has a molecular weight of 227.44 g/mol, XLogP of 4.76, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,2-dimethylundecan-1-amine is sourced from PubChem (CID 63508847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).