3-methoxy-3-methyl-N-propyldecan-4-amine

C15H33NO — CID 116758213

IUPAC3-methoxy-3-methyl-N-propyldecan-4-amine
SMILESCCCCCCC(NCCC)C(C)(CC)OC
InChIInChI=1S/C15H33NO/c1-6-9-10-11-12-14(16-13-7-2)15(4,8-3)17-5/h14,16H,6-13H2,1-5H3
InChIKeyGELVEYFVGVLAOQ-UHFFFAOYSA-N
MW243.43 g/mol
LogP4.14
Rot. Bonds11

About 3-methoxy-3-methyl-N-propyldecan-4-amine

3-methoxy-3-methyl-N-propyldecan-4-amine (PubChem CID 116758213) has the molecular formula C15H33NO and a molecular weight of 243.43 g/mol. Its IUPAC name is 3-methoxy-3-methyl-N-propyldecan-4-amine.

Molecular Properties

Compound Name3-methoxy-3-methyl-N-propyldecan-4-amine
PubChem CID116758213
Molecular FormulaC15H33NO
Molecular Weight243.43 g/mol
Exact Mass243.26
IUPAC Name3-methoxy-3-methyl-N-propyldecan-4-amine
SMILESCCCCCCC(NCCC)C(C)(CC)OC
InChIInChI=1S/C15H33NO/c1-6-9-10-11-12-14(16-13-7-2)15(4,8-3)17-5/h14,16H,6-13H2,1-5H3
InChIKeyGELVEYFVGVLAOQ-UHFFFAOYSA-N
XLogP4.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-methoxy-3-methyl-N-propyldecan-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

3-methoxy-3-methyl-N-propyldodecan-4-amine
CID 116758147
2-methoxy-2-methyl-N-propyldecan-3-amine
CID 79198158
3-methoxy-N,3-dimethylundecan-4-amine
CID 116757603
3-methoxy-3-methyl-N-propyloct-7-en-4-amine
CID 116758336
4-methoxy-4-methyl-1-methylsulfonyl-N-propylhexan-3-amine
CID 116758182
3-methoxy-3,6-dimethyl-N-propylnonan-4-amine
CID 116758239
3-methoxy-3-methylnonan-4-ol
CID 116751924
5-methoxy-2,5-dimethyl-N-propylhept-1-en-4-amine
CID 116758190
3-N,3-N-diethyl-3-methyl-4-N-propyldecane-3,4-diamine
CID 79069155
3-N,3-N-diethyl-3-methyl-4-N-propylundecane-3,4-diamine
CID 79058558
3-methoxy-3-methyltetradecan-4-amine
CID 116757437
2-methoxy-2-methyl-N-propylundecan-4-amine
CID 103025043

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-3-methyl-N-propyldecan-4-amine?
The IUPAC name of 3-methoxy-3-methyl-N-propyldecan-4-amine (CID 116758213) is 3-methoxy-3-methyl-N-propyldecan-4-amine.
What is the SMILES notation for 3-methoxy-3-methyl-N-propyldecan-4-amine?
The canonical SMILES for 3-methoxy-3-methyl-N-propyldecan-4-amine is CCCCCCC(NCCC)C(C)(CC)OC.
What is the InChIKey of 3-methoxy-3-methyl-N-propyldecan-4-amine?
The InChIKey is GELVEYFVGVLAOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO/c1-6-9-10-11-12-14(16-13-7-2)15(4,8-3)17-5/h14,16H,6-13H2,1-5H3.
What are the key properties of 3-methoxy-3-methyl-N-propyldecan-4-amine?
3-methoxy-3-methyl-N-propyldecan-4-amine has a molecular weight of 243.43 g/mol, XLogP of 4.14, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-3-methyl-N-propyldecan-4-amine is sourced from PubChem (CID 116758213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).