(2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine

C15H30N2O — CID 140917776

IUPAC(2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine
SMILESCCOC1CCC([C@@H](CN)N2CCCCC2)CC1
InChIInChI=1S/C15H30N2O/c1-2-18-14-8-6-13(7-9-14)15(12-16)17-10-4-3-5-11-17/h13-15H,2-12,16H2,1H3/t13?,14?,15-/m1/s1
InChIKeyMOJVOJPDGGOTLW-YMAMQOFZSA-N
MW254.42 g/mol
LogP2.39
Rot. Bonds5

About (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine

(2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine (PubChem CID 140917776) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine.

Molecular Properties

Compound Name(2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine
PubChem CID140917776
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name(2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine
SMILESCCOC1CCC([C@@H](CN)N2CCCCC2)CC1
InChIInChI=1S/C15H30N2O/c1-2-18-14-8-6-13(7-9-14)15(12-16)17-10-4-3-5-11-17/h13-15H,2-12,16H2,1H3/t13?,14?,15-/m1/s1
InChIKeyMOJVOJPDGGOTLW-YMAMQOFZSA-N
XLogP2.39
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine?
The IUPAC name of (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine (CID 140917776) is (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine.
What is the SMILES notation for (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine?
The canonical SMILES for (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine is CCOC1CCC([C@@H](CN)N2CCCCC2)CC1.
What is the InChIKey of (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine?
The InChIKey is MOJVOJPDGGOTLW-YMAMQOFZSA-N. The full InChI is InChI=1S/C15H30N2O/c1-2-18-14-8-6-13(7-9-14)15(12-16)17-10-4-3-5-11-17/h13-15H,2-12,16H2,1H3/t13?,14?,15-/m1/s1.
What are the key properties of (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine?
(2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine has a molecular weight of 254.42 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-ethoxycyclohexyl)-2-piperidin-1-ylethanamine is sourced from PubChem (CID 140917776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).