N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine

C16H32N2 — CID 55069404

IUPACN-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCC1CN(C)C(C)CC1NC(C)C1CCCCC1
InChIInChI=1S/C16H32N2/c1-12-11-18(4)13(2)10-16(12)17-14(3)15-8-6-5-7-9-15/h12-17H,5-11H2,1-4H3
InChIKeyWJEIHRSDOSNSSD-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.27
Rot. Bonds3

About N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine

N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine (PubChem CID 55069404) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine
PubChem CID55069404
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC NameN-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCC1CN(C)C(C)CC1NC(C)C1CCCCC1
InChIInChI=1S/C16H32N2/c1-12-11-18(4)13(2)10-16(12)17-14(3)15-8-6-5-7-9-15/h12-17H,5-11H2,1-4H3
InChIKeyWJEIHRSDOSNSSD-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine?
The IUPAC name of N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine (CID 55069404) is N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine.
What is the SMILES notation for N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine?
The canonical SMILES for N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine is CC1CN(C)C(C)CC1NC(C)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine?
The InChIKey is WJEIHRSDOSNSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-12-11-18(4)13(2)10-16(12)17-14(3)15-8-6-5-7-9-15/h12-17H,5-11H2,1-4H3.
What are the key properties of N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine?
N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine has a molecular weight of 252.45 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)-1,2,5-trimethylpiperidin-4-amine is sourced from PubChem (CID 55069404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).