1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine

C12H26N2O2 — CID 103411737

IUPAC1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine
SMILESCOCCOCCCN1CC(N)CCC1C
InChIInChI=1S/C12H26N2O2/c1-11-4-5-12(13)10-14(11)6-3-7-16-9-8-15-2/h11-12H,3-10,13H2,1-2H3
InChIKeyYIVVRZVUTUJGBM-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.85
Rot. Bonds7

About 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine

1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine (PubChem CID 103411737) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine.

Molecular Properties

Compound Name1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine
PubChem CID103411737
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine
SMILESCOCCOCCCN1CC(N)CCC1C
InChIInChI=1S/C12H26N2O2/c1-11-4-5-12(13)10-14(11)6-3-7-16-9-8-15-2/h11-12H,3-10,13H2,1-2H3
InChIKeyYIVVRZVUTUJGBM-UHFFFAOYSA-N
XLogP0.85
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-methyl-1-[2-(2-methylpropoxy)ethyl]piperidin-3-amine
CID 106455836
1-[3-(2-methoxyethoxy)propyl]-7-methyl-1,4-diazepane
CID 103414508
2-(chloromethyl)-4-[3-(2-methoxyethoxy)propyl]-5-methylmorpholine
CID 103413132
6-methyl-1-(3-methylbutyl)piperidin-3-amine
CID 61238617
1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
CID 103410154
5,5-diethyl-1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
CID 103414386
4-chloro-1-[3-(2-methoxyethoxy)propyl]piperidine
CID 103412995
1-[2-(3-methoxypropoxy)ethyl]-2-methylpiperidin-4-amine
CID 103181634
(2R,5R)-1-(3-methoxypropyl)-2,5-dimethylpyrrolidine
CID 89113469
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-7-methyl-3-propan-2-yl-1,4-diazepane
CID 104567944
2-tert-butyl-1-[3-(2-methoxyethoxy)propyl]-5-methylpiperazine
CID 103414098
5-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-2-methylpiperazine
CID 64862014

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine?
The IUPAC name of 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine (CID 103411737) is 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine.
What is the SMILES notation for 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine?
The canonical SMILES for 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine is COCCOCCCN1CC(N)CCC1C.
What is the InChIKey of 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine?
The InChIKey is YIVVRZVUTUJGBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-11-4-5-12(13)10-14(11)6-3-7-16-9-8-15-2/h11-12H,3-10,13H2,1-2H3.
What are the key properties of 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine?
1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine has a molecular weight of 230.35 g/mol, XLogP of 0.85, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methoxyethoxy)propyl]-6-methylpiperidin-3-amine is sourced from PubChem (CID 103411737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).