N-ethyl-2,3-dimethyldecan-4-amine

C14H31N — CID 115833855

IUPACN-ethyl-2,3-dimethyldecan-4-amine
SMILESCCCCCCC(NCC)C(C)C(C)C
InChIInChI=1S/C14H31N/c1-6-8-9-10-11-14(15-7-2)13(5)12(3)4/h12-15H,6-11H2,1-5H3
InChIKeyKKNNGLJMIYWYLT-UHFFFAOYSA-N
MW213.41 g/mol
LogP4.23
Rot. Bonds9

About N-ethyl-2,3-dimethyldecan-4-amine

N-ethyl-2,3-dimethyldecan-4-amine (PubChem CID 115833855) has the molecular formula C14H31N and a molecular weight of 213.41 g/mol. Its IUPAC name is N-ethyl-2,3-dimethyldecan-4-amine.

Molecular Properties

Compound NameN-ethyl-2,3-dimethyldecan-4-amine
PubChem CID115833855
Molecular FormulaC14H31N
Molecular Weight213.41 g/mol
Exact Mass213.25
IUPAC NameN-ethyl-2,3-dimethyldecan-4-amine
SMILESCCCCCCC(NCC)C(C)C(C)C
InChIInChI=1S/C14H31N/c1-6-8-9-10-11-14(15-7-2)13(5)12(3)4/h12-15H,6-11H2,1-5H3
InChIKeyKKNNGLJMIYWYLT-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.41
LogP ≤ 54.23
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

N-ethyl-2,3-dimethylundecan-4-amine
CID 115832523
N-ethyl-5-methyltridecan-6-amine
CID 114246331
2-ethoxy-N-ethylundecan-3-amine
CID 64535007
2,3-dimethylnonan-4-ylhydrazine
CID 105294701
N,5-diethylpentadecan-6-amine
CID 115831438
N-ethyl-3-propan-2-ylnonan-2-amine
CID 63401515
N-ethyl-2,3,6-trimethylnonan-4-amine
CID 115845744
N-ethyl-4-methoxyundecan-5-amine
CID 116719102
N-ethyl-4-methoxydodecan-5-amine
CID 116719103
3-ethoxy-N-ethylundecan-4-amine
CID 116716862
1-N,1-N'-diethyldecane-1,1-diamine
CID 141499810
N-ethyltetradecan-7-amine
CID 87847195

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,3-dimethyldecan-4-amine?
The IUPAC name of N-ethyl-2,3-dimethyldecan-4-amine (CID 115833855) is N-ethyl-2,3-dimethyldecan-4-amine.
What is the SMILES notation for N-ethyl-2,3-dimethyldecan-4-amine?
The canonical SMILES for N-ethyl-2,3-dimethyldecan-4-amine is CCCCCCC(NCC)C(C)C(C)C.
What is the InChIKey of N-ethyl-2,3-dimethyldecan-4-amine?
The InChIKey is KKNNGLJMIYWYLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N/c1-6-8-9-10-11-14(15-7-2)13(5)12(3)4/h12-15H,6-11H2,1-5H3.
What are the key properties of N-ethyl-2,3-dimethyldecan-4-amine?
N-ethyl-2,3-dimethyldecan-4-amine has a molecular weight of 213.41 g/mol, XLogP of 4.23, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,3-dimethyldecan-4-amine is sourced from PubChem (CID 115833855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).