1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine

C11H24N2O2 — CID 103177226

IUPAC1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine
SMILESCOCCCOCCN1CCC(N)CC1
InChIInChI=1S/C11H24N2O2/c1-14-8-2-9-15-10-7-13-5-3-11(12)4-6-13/h11H,2-10,12H2,1H3
InChIKeyOYVXIRQQAHCNDA-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.46
Rot. Bonds7

About 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine

1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine (PubChem CID 103177226) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine
PubChem CID103177226
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine
SMILESCOCCCOCCN1CCC(N)CC1
InChIInChI=1S/C11H24N2O2/c1-14-8-2-9-15-10-7-13-5-3-11(12)4-6-13/h11H,2-10,12H2,1H3
InChIKeyOYVXIRQQAHCNDA-UHFFFAOYSA-N
XLogP0.46
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.46
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

1-(3-methoxypropyl)piperidin-4-amine;hydrochloride
CID 141311767
1-(6-methoxyhexyl)piperidin-4-amine
CID 18001881
1-(2-methoxyethyl)piperidin-4-amine;hydrochloride
CID 146675245
1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine
CID 104560351
1-[2-(2-aminoethoxy)ethyl]piperidin-4-amine;ethane
CID 156883236
3-[4-[2-(3-methoxypropoxy)ethyl]piperazin-1-yl]propan-1-amine
CID 103178059
1-[2-(3-methoxypropoxy)ethyl]piperidine
CID 134364578
N-(cyclopropylmethyl)-1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine
CID 103181632
1-(3-ethoxypropyl)piperidin-4-amine
CID 18001948
[1-[2-(3-methoxypropoxy)ethyl]azetidin-3-yl]methanamine
CID 103184107
1-(5-propoxypentyl)piperidin-4-amine
CID 18002201
1-[2-[3-methoxypropyl(methyl)amino]ethyl]piperidin-4-amine
CID 79327540

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine?
The IUPAC name of 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine (CID 103177226) is 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine.
What is the SMILES notation for 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine?
The canonical SMILES for 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine is COCCCOCCN1CCC(N)CC1.
What is the InChIKey of 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine?
The InChIKey is OYVXIRQQAHCNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-14-8-2-9-15-10-7-13-5-3-11(12)4-6-13/h11H,2-10,12H2,1H3.
What are the key properties of 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine?
1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine has a molecular weight of 216.32 g/mol, XLogP of 0.46, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine is sourced from PubChem (CID 103177226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).