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

C16H34N2 — CID 62930484

IUPAC5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
SMILESCC(C)CNCCCCCN1CCC(C)(C)CC1
InChIInChI=1S/C16H34N2/c1-15(2)14-17-10-6-5-7-11-18-12-8-16(3,4)9-13-18/h15,17H,5-14H2,1-4H3
InChIKeyOQJYKSSZEFOOTP-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.52
Rot. Bonds8

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

5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine (PubChem CID 62930484) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine.

Molecular Properties

Compound Name5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
PubChem CID62930484
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
SMILESCC(C)CNCCCCCN1CCC(C)(C)CC1
InChIInChI=1S/C16H34N2/c1-15(2)14-17-10-6-5-7-11-18-12-8-16(3,4)9-13-18/h15,17H,5-14H2,1-4H3
InChIKeyOQJYKSSZEFOOTP-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
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-ethyl-4-methylpiperidin-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 63160182
5-(azepan-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 62438364
5-(4,4-dimethylpiperidin-1-yl)-N-propylpentan-1-amine
CID 62930314
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
5-(4-ethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 55069235
4-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 62422628
6-(4,4-dimethylazepan-1-yl)-N-propylhexan-1-amine
CID 65286566
5-(4-butan-2-ylpiperazin-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 62774852
4,4-dimethyl-1-(4-methylpentyl)piperidine;ethane
CID 142891140
5,5-dimethyl-1-[3-(2-methylpropylamino)propyl]azepan-2-one
CID 65284086
1-hexyl-4,4-dimethylpiperidine
CID 18722930

Frequently Asked Questions

What is the IUPAC name of 5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The IUPAC name of 5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine (CID 62930484) is 5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine.
What is the SMILES notation for 5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The canonical SMILES for 5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine is CC(C)CNCCCCCN1CCC(C)(C)CC1.
What is the InChIKey of 5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
The InChIKey is OQJYKSSZEFOOTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-15(2)14-17-10-6-5-7-11-18-12-8-16(3,4)9-13-18/h15,17H,5-14H2,1-4H3.
What are the key properties of 5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine?
5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.52, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,4-dimethylpiperidin-1-yl)-N-(2-methylpropyl)pentan-1-amine is sourced from PubChem (CID 62930484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).