N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine

C16H32N2O2 — CID 63903035

IUPACN-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine
SMILESCOCCN(CCCOC1CCNCC1)C(C)C1CC1
InChIInChI=1S/C16H32N2O2/c1-14(15-4-5-15)18(11-13-19-2)10-3-12-20-16-6-8-17-9-7-16/h14-17H,3-13H2,1-2H3
InChIKeyFPKVXLZVGIPRHG-UHFFFAOYSA-N
MW284.44 g/mol
LogP1.89
Rot. Bonds10

About N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine

N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine (PubChem CID 63903035) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine
PubChem CID63903035
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC NameN-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine
SMILESCOCCN(CCCOC1CCNCC1)C(C)C1CC1
InChIInChI=1S/C16H32N2O2/c1-14(15-4-5-15)18(11-13-19-2)10-3-12-20-16-6-8-17-9-7-16/h14-17H,3-13H2,1-2H3
InChIKeyFPKVXLZVGIPRHG-UHFFFAOYSA-N
XLogP1.89
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 51.89
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-cyclopropyl-N-(2-methoxyethyl)-N-(2-piperidin-4-yloxyethyl)ethanamine
CID 55252268
N,2-dimethyl-N-(3-piperidin-4-yloxypropyl)propan-1-amine
CID 63905483
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-2-methylpentane-1,5-diamine
CID 82016982
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-2-methylbutane-1,4-diamine
CID 81079207
N-[2-(8-azabicyclo[3.2.1]octan-3-yl)ethyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine
CID 79615271
4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]piperidine;hydrochloride
CID 118540846
4-(4-methylpentoxy)azepane
CID 63904463
N-(azepan-2-ylmethyl)-1-cyclopropyl-N-(2-methoxyethyl)ethanamine
CID 64570567
1-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]-2-methylbutan-2-ol
CID 64820243
3-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 103411120
4-pentoxypiperidine
CID 43167830
1-cyclopropyl-N-(2-methoxyethyl)-N-[(3-methylpiperidin-3-yl)methyl]ethanamine
CID 55164329

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine?
The IUPAC name of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine (CID 63903035) is N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine is COCCN(CCCOC1CCNCC1)C(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine?
The InChIKey is FPKVXLZVGIPRHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-14(15-4-5-15)18(11-13-19-2)10-3-12-20-16-6-8-17-9-7-16/h14-17H,3-13H2,1-2H3.
What are the key properties of N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine?
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine has a molecular weight of 284.44 g/mol, XLogP of 1.89, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-piperidin-4-yloxypropan-1-amine is sourced from PubChem (CID 63903035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).