1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine

C14H30N2O — CID 79397144

IUPAC1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CCCOC)C(C)C1C
InChIInChI=1S/C14H30N2O/c1-5-8-15-14-7-10-16(9-6-11-17-4)13(3)12(14)2/h12-15H,5-11H2,1-4H3
InChIKeyLCVLYDAHLKUEQT-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.12
Rot. Bonds7

About 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine

1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine (PubChem CID 79397144) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine
PubChem CID79397144
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CCCOC)C(C)C1C
InChIInChI=1S/C14H30N2O/c1-5-8-15-14-7-10-16(9-6-11-17-4)13(3)12(14)2/h12-15H,5-11H2,1-4H3
InChIKeyLCVLYDAHLKUEQT-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-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

1-[4-(dimethylamino)butyl]-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79406875
2,3-dimethyl-N-propyl-1-(3,3,3-trifluoropropyl)piperidin-4-amine
CID 79406592
2,3-dimethyl-N-propyl-1-(2-thiomorpholin-4-ylethyl)piperidin-4-amine
CID 106325781
2,3-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]-N-propylpiperidin-4-amine
CID 79407138
2,3-dimethyl-1-(2-phenylethyl)-N-propylpiperidin-4-amine
CID 79398266
1-[(4-ethylcyclohexyl)methyl]-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79413433
2,3-dimethyl-1-(2-prop-2-enylsulfanylethyl)-N-propylpiperidin-4-amine
CID 106429737
2,3-dimethyl-1-(2-methylsulfanylpropyl)-N-propylpiperidin-4-amine
CID 113466578
1-[3-(dimethylamino)propyl]-N-ethyl-2,3-dimethylpiperidin-4-amine
CID 79397146
2,3-dimethyl-N-propyl-1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine
CID 79406175
1-[2-(2-methoxyethoxy)ethyl]-N,2,3-trimethylpiperidin-4-amine
CID 79407787
1-[(2-ethylphenyl)methyl]-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79413586

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine?
The IUPAC name of 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine (CID 79397144) is 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine?
The canonical SMILES for 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine is CCCNC1CCN(CCCOC)C(C)C1C.
What is the InChIKey of 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine?
The InChIKey is LCVLYDAHLKUEQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-8-15-14-7-10-16(9-6-11-17-4)13(3)12(14)2/h12-15H,5-11H2,1-4H3.
What are the key properties of 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine?
1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine has a molecular weight of 242.41 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypropyl)-2,3-dimethyl-N-propylpiperidin-4-amine is sourced from PubChem (CID 79397144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).