(1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone

C13H24N2O2 — CID 43592838

IUPAC(1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone
SMILESCC1(C)CN(C(=O)C2(N)CCCCC2)CCO1
InChIInChI=1S/C13H24N2O2/c1-12(2)10-15(8-9-17-12)11(16)13(14)6-4-3-5-7-13/h3-10,14H2,1-2H3
InChIKeyFHIYLBAHBXORKG-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.29
Rot. Bonds1

About (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone

(1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone (PubChem CID 43592838) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone
PubChem CID43592838
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name(1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone
SMILESCC1(C)CN(C(=O)C2(N)CCCCC2)CCO1
InChIInChI=1S/C13H24N2O2/c1-12(2)10-15(8-9-17-12)11(16)13(14)6-4-3-5-7-13/h3-10,14H2,1-2H3
InChIKeyFHIYLBAHBXORKG-UHFFFAOYSA-N
XLogP1.29
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone?
The IUPAC name of (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone (CID 43592838) is (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone.
What is the SMILES notation for (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone?
The canonical SMILES for (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone is CC1(C)CN(C(=O)C2(N)CCCCC2)CCO1.
What is the InChIKey of (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone?
The InChIKey is FHIYLBAHBXORKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-12(2)10-15(8-9-17-12)11(16)13(14)6-4-3-5-7-13/h3-10,14H2,1-2H3.
What are the key properties of (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone?
(1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclohexyl)-(2,2-dimethylmorpholin-4-yl)methanone is sourced from PubChem (CID 43592838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).