N-ethyl-2-methoxy-2-methyldecan-4-amine

C14H31NO — CID 103025050

IUPACN-ethyl-2-methoxy-2-methyldecan-4-amine
SMILESCCCCCCC(CC(C)(C)OC)NCC
InChIInChI=1S/C14H31NO/c1-6-8-9-10-11-13(15-7-2)12-14(3,4)16-5/h13,15H,6-12H2,1-5H3
InChIKeyGCWCJUWJWPHMSD-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.75
Rot. Bonds10

About N-ethyl-2-methoxy-2-methyldecan-4-amine

N-ethyl-2-methoxy-2-methyldecan-4-amine (PubChem CID 103025050) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is N-ethyl-2-methoxy-2-methyldecan-4-amine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-2-methyldecan-4-amine
PubChem CID103025050
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC NameN-ethyl-2-methoxy-2-methyldecan-4-amine
SMILESCCCCCCC(CC(C)(C)OC)NCC
InChIInChI=1S/C14H31NO/c1-6-8-9-10-11-13(15-7-2)12-14(3,4)16-5/h13,15H,6-12H2,1-5H3
InChIKeyGCWCJUWJWPHMSD-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-ethyl-2-methoxy-2-methyldecan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8,8,8-trifluoro-2-methoxy-N,2-dimethyloctan-4-amine
CID 103028745
N-ethyl-1,1,1-trifluoro-6-methoxy-6-methylheptan-3-amine
CID 103031103
N-ethyl-2-methoxy-2-methyltridecan-4-amine
CID 103025039
2-methoxy-2-methyl-N-propyltridecan-4-amine
CID 103025040
2-Methoxy-2-methylundecan-4-amine
CID 103025041
2-methoxy-N,2-dimethylundecan-4-amine
CID 103025042
2-Methoxy-2-methyloctan-4-amine
CID 103025044
2-Methoxy-2-methyldecan-4-amine
CID 103025049
2-methoxy-N,2,7-trimethyloctan-4-amine
CID 103025053
2-methoxy-2,7-dimethyl-N-propyloctan-4-amine
CID 103025055
2-Methoxy-2-methyldodecan-4-amine
CID 103025056
2-methoxy-N,2-dimethyldodecan-4-amine
CID 103025057

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-2-methyldecan-4-amine?
The IUPAC name of N-ethyl-2-methoxy-2-methyldecan-4-amine (CID 103025050) is N-ethyl-2-methoxy-2-methyldecan-4-amine.
What is the SMILES notation for N-ethyl-2-methoxy-2-methyldecan-4-amine?
The canonical SMILES for N-ethyl-2-methoxy-2-methyldecan-4-amine is CCCCCCC(CC(C)(C)OC)NCC.
What is the InChIKey of N-ethyl-2-methoxy-2-methyldecan-4-amine?
The InChIKey is GCWCJUWJWPHMSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-6-8-9-10-11-13(15-7-2)12-14(3,4)16-5/h13,15H,6-12H2,1-5H3.
What are the key properties of N-ethyl-2-methoxy-2-methyldecan-4-amine?
N-ethyl-2-methoxy-2-methyldecan-4-amine has a molecular weight of 229.41 g/mol, XLogP of 3.75, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-2-methyldecan-4-amine is sourced from PubChem (CID 103025050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).