[4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine

C15H30N2 — CID 43293344

IUPAC[4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCCC1CCC(CN)C(N2CCCCC2C)C1
InChIInChI=1S/C15H30N2/c1-3-13-7-8-14(11-16)15(10-13)17-9-5-4-6-12(17)2/h12-15H,3-11,16H2,1-2H3
InChIKeyGMAYGQKKMQOIJO-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.01
Rot. Bonds3

About [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine

[4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine (PubChem CID 43293344) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine
PubChem CID43293344
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name[4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCCC1CCC(CN)C(N2CCCCC2C)C1
InChIInChI=1S/C15H30N2/c1-3-13-7-8-14(11-16)15(10-13)17-9-5-4-6-12(17)2/h12-15H,3-11,16H2,1-2H3
InChIKeyGMAYGQKKMQOIJO-UHFFFAOYSA-N
XLogP3.01
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine?
The IUPAC name of [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine (CID 43293344) is [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine.
What is the SMILES notation for [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine?
The canonical SMILES for [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine is CCC1CCC(CN)C(N2CCCCC2C)C1.
What is the InChIKey of [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine?
The InChIKey is GMAYGQKKMQOIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-3-13-7-8-14(11-16)15(10-13)17-9-5-4-6-12(17)2/h12-15H,3-11,16H2,1-2H3.
What are the key properties of [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine?
[4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine has a molecular weight of 238.42 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine is sourced from PubChem (CID 43293344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).