3-methoxy-3,6-dimethyl-N-propylnonan-4-amine

C15H33NO — CID 116758239

IUPAC3-methoxy-3,6-dimethyl-N-propylnonan-4-amine
SMILESCCCNC(CC(C)CCC)C(C)(CC)OC
InChIInChI=1S/C15H33NO/c1-7-10-13(4)12-14(16-11-8-2)15(5,9-3)17-6/h13-14,16H,7-12H2,1-6H3
InChIKeyLILHTFRBKUTXOG-UHFFFAOYSA-N
MW243.43 g/mol
LogP4.00
Rot. Bonds10

About 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine

3-methoxy-3,6-dimethyl-N-propylnonan-4-amine (PubChem CID 116758239) has the molecular formula C15H33NO and a molecular weight of 243.43 g/mol. Its IUPAC name is 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine.

Molecular Properties

Compound Name3-methoxy-3,6-dimethyl-N-propylnonan-4-amine
PubChem CID116758239
Molecular FormulaC15H33NO
Molecular Weight243.43 g/mol
Exact Mass243.26
IUPAC Name3-methoxy-3,6-dimethyl-N-propylnonan-4-amine
SMILESCCCNC(CC(C)CCC)C(C)(CC)OC
InChIInChI=1S/C15H33NO/c1-7-10-13(4)12-14(16-11-8-2)15(5,9-3)17-6/h13-14,16H,7-12H2,1-6H3
InChIKeyLILHTFRBKUTXOG-UHFFFAOYSA-N
XLogP4.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methoxy-3,6-dimethyl-N-propylnonan-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-methoxy-2,5-dimethyl-N-propyloctan-3-amine
CID 79198397
3-methoxy-3-methyl-N-propyldecan-4-amine
CID 116758213
3-methoxy-3-methyl-N-propyldodecan-4-amine
CID 116758147
3-methoxy-3-methyl-N-propyloct-7-en-4-amine
CID 116758336
4-methoxy-4-methyl-1-methylsulfonyl-N-propylhexan-3-amine
CID 116758182
2,5-dimethyl-2-methylsulfonyl-N-propyloctan-3-amine
CID 115845249
5-methoxy-2,5-dimethyl-N-propylhept-1-en-4-amine
CID 116758190
5-ethyl-5-methoxy-2-methyl-N-propylheptan-4-amine
CID 116761321
2-(azepan-1-yl)-2,5-dimethyl-N-propyloctan-3-amine
CID 79051683
2-(4-fluorophenyl)-2,5-dimethyl-N-propyloctan-3-amine
CID 64769158
3-ethyl-3-methoxy-7-methyl-N-propyloctan-4-amine
CID 116761328
3-methoxy-3-methyl-1-(2-methylphenyl)-N-propylpentan-2-amine
CID 116758206

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine?
The IUPAC name of 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine (CID 116758239) is 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine.
What is the SMILES notation for 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine?
The canonical SMILES for 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine is CCCNC(CC(C)CCC)C(C)(CC)OC.
What is the InChIKey of 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine?
The InChIKey is LILHTFRBKUTXOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO/c1-7-10-13(4)12-14(16-11-8-2)15(5,9-3)17-6/h13-14,16H,7-12H2,1-6H3.
What are the key properties of 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine?
3-methoxy-3,6-dimethyl-N-propylnonan-4-amine has a molecular weight of 243.43 g/mol, XLogP of 4.00, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-3,6-dimethyl-N-propylnonan-4-amine is sourced from PubChem (CID 116758239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).