[4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone

C13H24N2O2 — CID 134917897

IUPAC[4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone
SMILESCN(C)C1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C13H24N2O2/c1-14(2)12-5-3-11(4-6-12)13(16)15-7-9-17-10-8-15/h11-12H,3-10H2,1-2H3
InChIKeySTLIBIBFENRBRG-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.97
Rot. Bonds2

About [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone

[4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone (PubChem CID 134917897) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone
PubChem CID134917897
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name[4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone
SMILESCN(C)C1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C13H24N2O2/c1-14(2)12-5-3-11(4-6-12)13(16)15-7-9-17-10-8-15/h11-12H,3-10H2,1-2H3
InChIKeySTLIBIBFENRBRG-UHFFFAOYSA-N
XLogP0.97
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone?
The IUPAC name of [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone (CID 134917897) is [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone?
The canonical SMILES for [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone is CN(C)C1CCC(C(=O)N2CCOCC2)CC1.
What is the InChIKey of [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone?
The InChIKey is STLIBIBFENRBRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-14(2)12-5-3-11(4-6-12)13(16)15-7-9-17-10-8-15/h11-12H,3-10H2,1-2H3.
What are the key properties of [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone?
[4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone has a molecular weight of 240.35 g/mol, XLogP of 0.97, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)cyclohexyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 134917897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).