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

C14H26N2O2 — CID 55114982

IUPAC[4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone
SMILESCC1CN(C(=O)C2CCC(CN)CC2)CC(C)O1
InChIInChI=1S/C14H26N2O2/c1-10-8-16(9-11(2)18-10)14(17)13-5-3-12(7-15)4-6-13/h10-13H,3-9,15H2,1-2H3
InChIKeyCJJAUHIYAQFPEU-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.39
Rot. Bonds2

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

[4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone (PubChem CID 55114982) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is [4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name[4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone
PubChem CID55114982
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name[4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone
SMILESCC1CN(C(=O)C2CCC(CN)CC2)CC(C)O1
InChIInChI=1S/C14H26N2O2/c1-10-8-16(9-11(2)18-10)14(17)13-5-3-12(7-15)4-6-13/h10-13H,3-9,15H2,1-2H3
InChIKeyCJJAUHIYAQFPEU-UHFFFAOYSA-N
XLogP1.39
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone?
The IUPAC name of [4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone (CID 55114982) is [4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone.
What is the SMILES notation for [4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone?
The canonical SMILES for [4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone is CC1CN(C(=O)C2CCC(CN)CC2)CC(C)O1.
What is the InChIKey of [4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone?
The InChIKey is CJJAUHIYAQFPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-10-8-16(9-11(2)18-10)14(17)13-5-3-12(7-15)4-6-13/h10-13H,3-9,15H2,1-2H3.
What are the key properties of [4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone?
[4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone has a molecular weight of 254.37 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(aminomethyl)cyclohexyl]-(2,6-dimethylmorpholin-4-yl)methanone is sourced from PubChem (CID 55114982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).