N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine

C16H34N2 — CID 79065446

IUPACN,3,7-trimethyl-3-piperidin-1-yloctan-4-amine
SMILESCCC(C)(C(CCC(C)C)NC)N1CCCCC1
InChIInChI=1S/C16H34N2/c1-6-16(4,18-12-8-7-9-13-18)15(17-5)11-10-14(2)3/h14-15,17H,6-13H2,1-5H3
InChIKeyXORZYERIOXWSIO-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.67
Rot. Bonds7

About N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine

N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine (PubChem CID 79065446) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine.

Molecular Properties

Compound NameN,3,7-trimethyl-3-piperidin-1-yloctan-4-amine
PubChem CID79065446
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC NameN,3,7-trimethyl-3-piperidin-1-yloctan-4-amine
SMILESCCC(C)(C(CCC(C)C)NC)N1CCCCC1
InChIInChI=1S/C16H34N2/c1-6-16(4,18-12-8-7-9-13-18)15(17-5)11-10-14(2)3/h14-15,17H,6-13H2,1-5H3
InChIKeyXORZYERIOXWSIO-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine?
The IUPAC name of N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine (CID 79065446) is N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine.
What is the SMILES notation for N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine?
The canonical SMILES for N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine is CCC(C)(C(CCC(C)C)NC)N1CCCCC1.
What is the InChIKey of N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine?
The InChIKey is XORZYERIOXWSIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-6-16(4,18-12-8-7-9-13-18)15(17-5)11-10-14(2)3/h14-15,17H,6-13H2,1-5H3.
What are the key properties of N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine?
N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine has a molecular weight of 254.46 g/mol, XLogP of 3.67, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine is sourced from PubChem (CID 79065446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).