5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine

C16H34N2 — CID 55069235

IUPAC5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
SMILESCCC1CCN(CCCCCNCC(C)C)CC1
InChIInChI=1S/C16H34N2/c1-4-16-8-12-18(13-9-16)11-7-5-6-10-17-14-15(2)3/h15-17H,4-14H2,1-3H3
InChIKeyIYYJZUDDOFIZEO-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.52
Rot. Bonds9

About 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine

5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine (PubChem CID 55069235) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine.

Molecular Properties

Compound Name5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
PubChem CID55069235
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
SMILESCCC1CCN(CCCCCNCC(C)C)CC1
InChIInChI=1S/C16H34N2/c1-4-16-8-12-18(13-9-16)11-7-5-6-10-17-14-15(2)3/h15-17H,4-14H2,1-3H3
InChIKeyIYYJZUDDOFIZEO-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 62422628
5-(azepan-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 62438364
5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 62930484
ethane;4-ethyl-1-(6-methylheptyl)piperidine
CID 170614915
N-(2-methylpropyl)-4-piperidin-1-ylbutan-1-amine
CID 62425413
N-(2-methylpropyl)-8-(4-propan-2-ylpiperazin-1-yl)octan-1-amine
CID 174276401
6-[4-[(2-methylpropylamino)methyl]piperidin-1-yl]hexan-1-ol
CID 107707143
5-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 62774852
2-methyl-N-[2-(4-propylpiperidin-1-yl)ethyl]propan-1-amine
CID 62437822
N-[4-(4-ethylpiperidin-1-yl)butyl]cyclopropanamine
CID 62412900
2-methyl-N-[2-(4-propan-2-ylpiperidin-1-yl)ethyl]propan-1-amine
CID 103503235
N-[3-[3-(methoxymethyl)pyrrolidin-1-yl]propyl]-2-methylpropan-1-amine
CID 64570291

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The IUPAC name of 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine (CID 55069235) is 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine.
What is the SMILES notation for 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The canonical SMILES for 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine is CCC1CCN(CCCCCNCC(C)C)CC1.
What is the InChIKey of 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The InChIKey is IYYJZUDDOFIZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-4-16-8-12-18(13-9-16)11-7-5-6-10-17-14-15(2)3/h15-17H,4-14H2,1-3H3.
What are the key properties of 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.52, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine is sourced from PubChem (CID 55069235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).