[2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone

C16H30N2O2 — CID 102743617

IUPAC[2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
SMILESCC1(C)CN(C(=O)C2CCCCC2CN)CC(C)(C)O1
InChIInChI=1S/C16H30N2O2/c1-15(2)10-18(11-16(3,4)20-15)14(19)13-8-6-5-7-12(13)9-17/h12-13H,5-11,17H2,1-4H3
InChIKeySIYRBRLYVBSXLU-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.17
Rot. Bonds2

About [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone

[2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone (PubChem CID 102743617) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name[2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
PubChem CID102743617
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name[2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
SMILESCC1(C)CN(C(=O)C2CCCCC2CN)CC(C)(C)O1
InChIInChI=1S/C16H30N2O2/c1-15(2)10-18(11-16(3,4)20-15)14(19)13-8-6-5-7-12(13)9-17/h12-13H,5-11,17H2,1-4H3
InChIKeySIYRBRLYVBSXLU-UHFFFAOYSA-N
XLogP2.17
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
The IUPAC name of [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone (CID 102743617) is [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone.
What is the SMILES notation for [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
The canonical SMILES for [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone is CC1(C)CN(C(=O)C2CCCCC2CN)CC(C)(C)O1.
What is the InChIKey of [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
The InChIKey is SIYRBRLYVBSXLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-15(2)10-18(11-16(3,4)20-15)14(19)13-8-6-5-7-12(13)9-17/h12-13H,5-11,17H2,1-4H3.
What are the key properties of [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
[2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone has a molecular weight of 282.43 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)cyclohexyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone is sourced from PubChem (CID 102743617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).