2-methoxy-2-methyldecan-4-amine

C12H27NO — CID 103025049

IUPAC2-methoxy-2-methyldecan-4-amine
SMILESCCCCCCC(N)CC(C)(C)OC
InChIInChI=1S/C12H27NO/c1-5-6-7-8-9-11(13)10-12(2,3)14-4/h11H,5-10,13H2,1-4H3
InChIKeyLNHQZOASQLYJLA-UHFFFAOYSA-N
MW201.35 g/mol
LogP3.10
Rot. Bonds8

About 2-methoxy-2-methyldecan-4-amine

2-methoxy-2-methyldecan-4-amine (PubChem CID 103025049) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is 2-methoxy-2-methyldecan-4-amine.

Molecular Properties

Compound Name2-methoxy-2-methyldecan-4-amine
PubChem CID103025049
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC Name2-methoxy-2-methyldecan-4-amine
SMILESCCCCCCC(N)CC(C)(C)OC
InChIInChI=1S/C12H27NO/c1-5-6-7-8-9-11(13)10-12(2,3)14-4/h11H,5-10,13H2,1-4H3
InChIKeyLNHQZOASQLYJLA-UHFFFAOYSA-N
XLogP3.10
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 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

2-(2-Methylpropyl)oxan-4-amine
CID 64104920
2-(1-Methoxycyclohexyl)ethan-1-amine
CID 83872899
2-Methoxy-2-methylnonan-1-amine
CID 66072171
1,1,1-Trifluoro-6-methoxy-6-methylheptan-4-amine
CID 103027354
8,8,8-Trifluoro-2-methoxy-2-methyloctan-4-amine
CID 103028746
1,1,1-Trifluoro-7-methoxy-7-methyloctan-4-amine
CID 103032393
6,6,6-Trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine
CID 103559718
3-Amino-2-methylnonan-2-ol
CID 13585930
2-Methyl-3-[(2-methylpropan-2-yl)oxy]octan-1-amine
CID 20230566
2-Ethyl-2,6-dimethyloxan-4-amine
CID 20821375
7-Amino-2-methyloctan-2-ol
CID 23591595
4-Amino-2-methylnonadecan-2-ol
CID 54338746

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyldecan-4-amine?
The IUPAC name of 2-methoxy-2-methyldecan-4-amine (CID 103025049) is 2-methoxy-2-methyldecan-4-amine.
What is the SMILES notation for 2-methoxy-2-methyldecan-4-amine?
The canonical SMILES for 2-methoxy-2-methyldecan-4-amine is CCCCCCC(N)CC(C)(C)OC.
What is the InChIKey of 2-methoxy-2-methyldecan-4-amine?
The InChIKey is LNHQZOASQLYJLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO/c1-5-6-7-8-9-11(13)10-12(2,3)14-4/h11H,5-10,13H2,1-4H3.
What are the key properties of 2-methoxy-2-methyldecan-4-amine?
2-methoxy-2-methyldecan-4-amine has a molecular weight of 201.35 g/mol, XLogP of 3.10, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyldecan-4-amine is sourced from PubChem (CID 103025049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).