6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine

C15H32N2 — CID 106707970

IUPAC6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine
SMILESCCC1CCN(CCCCC(C)(C)CN)CC1
InChIInChI=1S/C15H32N2/c1-4-14-7-11-17(12-8-14)10-6-5-9-15(2,3)13-16/h14H,4-13,16H2,1-3H3
InChIKeyDRFWJIQPIFABFA-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.26
Rot. Bonds7

About 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine

6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine (PubChem CID 106707970) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine.

Molecular Properties

Compound Name6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine
PubChem CID106707970
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine
SMILESCCC1CCN(CCCCC(C)(C)CN)CC1
InChIInChI=1S/C15H32N2/c1-4-14-7-11-17(12-8-14)10-6-5-9-15(2,3)13-16/h14H,4-13,16H2,1-3H3
InChIKeyDRFWJIQPIFABFA-UHFFFAOYSA-N
XLogP3.26
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.26
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

1-amino-6-(4-ethylpiperidin-1-yl)-2-methylhexan-2-ol
CID 64818689
4-(4-ethylazepan-1-yl)-2,2-dimethylbutan-1-amine
CID 65247436
2,2-dimethyl-6-(4-methylazepan-1-yl)hexan-1-amine
CID 106708126
N-[1-(6-amino-5,5-dimethylhexyl)piperidin-4-yl]acetamide
CID 106708228
1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol
CID 106708252
2,2-dimethyl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)hexan-1-amine
CID 106708095
5-[3-(methoxymethyl)pyrrolidin-1-yl]-2,2-dimethylpentan-1-amine
CID 65254280
2,2-dimethyl-5-(4-methylpiperazin-1-yl)pentan-1-amine
CID 65256580
4-ethyl-1-hexylpiperidine;formonitrile
CID 175874680
5-(4,4-diethylpiperidin-1-yl)-2,2-dimethylpentan-1-amine
CID 65254542
5-(4-ethylazepan-1-yl)-2,2-dimethylpentanoic acid
CID 65254850
1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide
CID 106707851

Frequently Asked Questions

What is the IUPAC name of 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine?
The IUPAC name of 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine (CID 106707970) is 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine.
What is the SMILES notation for 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine?
The canonical SMILES for 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine is CCC1CCN(CCCCC(C)(C)CN)CC1.
What is the InChIKey of 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine?
The InChIKey is DRFWJIQPIFABFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-4-14-7-11-17(12-8-14)10-6-5-9-15(2,3)13-16/h14H,4-13,16H2,1-3H3.
What are the key properties of 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine?
6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine has a molecular weight of 240.43 g/mol, XLogP of 3.26, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine is sourced from PubChem (CID 106707970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).