N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine

C17H36N2 — CID 114507460

IUPACN,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine
SMILESCCCCC(CC)CN1CCC(NCC)C(CC)C1
InChIInChI=1S/C17H36N2/c1-5-9-10-15(6-2)13-19-12-11-17(18-8-4)16(7-3)14-19/h15-18H,5-14H2,1-4H3
InChIKeyUDWNCETVHPIGFT-UHFFFAOYSA-N
MW268.49 g/mol
LogP3.91
Rot. Bonds9

About N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine

N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine (PubChem CID 114507460) has the molecular formula C17H36N2 and a molecular weight of 268.49 g/mol. Its IUPAC name is N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine.

Molecular Properties

Compound NameN,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine
PubChem CID114507460
Molecular FormulaC17H36N2
Molecular Weight268.49 g/mol
Exact Mass268.29
IUPAC NameN,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine
SMILESCCCCC(CC)CN1CCC(NCC)C(CC)C1
InChIInChI=1S/C17H36N2/c1-5-9-10-15(6-2)13-19-12-11-17(18-8-4)16(7-3)14-19/h15-18H,5-14H2,1-4H3
InChIKeyUDWNCETVHPIGFT-UHFFFAOYSA-N
XLogP3.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.49
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,3-diethyl-1-(2-ethylbutyl)piperidin-4-amine
CID 114507419
3-ethyl-1-(2-ethylhexyl)-N-propylpiperidin-4-amine
CID 114507677
N-ethyl-1-(2-ethylhexyl)pyrrolidin-3-amine
CID 107815392
1-(2-ethylhexyl)-N,3-dimethylpiperidin-4-amine
CID 114499149
4-bromo-1-(2-ethylhexyl)piperidine
CID 80678889
2-[1-(2-ethylhexyl)pyrrolidin-3-yl]ethanol
CID 104627914
4-(1-chloroethyl)-1-(2-ethylhexyl)piperidine
CID 106837967
1-(2-ethylhexyl)-4,6-dimethyl-1,5-diazocane
CID 107817900
3-[3-ethyl-4-(propylamino)piperidin-1-yl]-2-methylpropan-1-ol
CID 114507604
N,3-diethyl-1-(2-methylsulfonylethyl)piperidin-4-amine
CID 114507432
N-[[1-(2-ethylhexyl)piperidin-4-yl]methyl]-2-methylpropan-2-amine
CID 62592756
2-[3-ethyl-4-(ethylamino)piperidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 114507471

Frequently Asked Questions

What is the IUPAC name of N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine?
The IUPAC name of N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine (CID 114507460) is N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine.
What is the SMILES notation for N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine?
The canonical SMILES for N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine is CCCCC(CC)CN1CCC(NCC)C(CC)C1.
What is the InChIKey of N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine?
The InChIKey is UDWNCETVHPIGFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2/c1-5-9-10-15(6-2)13-19-12-11-17(18-8-4)16(7-3)14-19/h15-18H,5-14H2,1-4H3.
What are the key properties of N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine?
N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine has a molecular weight of 268.49 g/mol, XLogP of 3.91, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-diethyl-1-(2-ethylhexyl)piperidin-4-amine is sourced from PubChem (CID 114507460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).