[1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine

C14H28N2O — CID 24697713

IUPAC[1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine
SMILESCC1CN(C2(CN)CCCCCC2)CC(C)O1
InChIInChI=1S/C14H28N2O/c1-12-9-16(10-13(2)17-12)14(11-15)7-5-3-4-6-8-14/h12-13H,3-11,15H2,1-2H3
InChIKeyCFXRREOVMREJHO-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.15
Rot. Bonds2

About [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine

[1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine (PubChem CID 24697713) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine.

Molecular Properties

Compound Name[1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine
PubChem CID24697713
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name[1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine
SMILESCC1CN(C2(CN)CCCCCC2)CC(C)O1
InChIInChI=1S/C14H28N2O/c1-12-9-16(10-13(2)17-12)14(11-15)7-5-3-4-6-8-14/h12-13H,3-11,15H2,1-2H3
InChIKeyCFXRREOVMREJHO-UHFFFAOYSA-N
XLogP2.15
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine?
The IUPAC name of [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine (CID 24697713) is [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine.
What is the SMILES notation for [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine?
The canonical SMILES for [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine is CC1CN(C2(CN)CCCCCC2)CC(C)O1.
What is the InChIKey of [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine?
The InChIKey is CFXRREOVMREJHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12-9-16(10-13(2)17-12)14(11-15)7-5-3-4-6-8-14/h12-13H,3-11,15H2,1-2H3.
What are the key properties of [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine?
[1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine has a molecular weight of 240.39 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dimethylmorpholin-4-yl)cycloheptyl]methanamine is sourced from PubChem (CID 24697713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).