N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide

C13H24N2O2 — CID 113255358

IUPACN-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide
SMILESCC1(C)CCCCC1NC(=O)N1CCOCC1
InChIInChI=1S/C13H24N2O2/c1-13(2)6-4-3-5-11(13)14-12(16)15-7-9-17-10-8-15/h11H,3-10H2,1-2H3,(H,14,16)
InChIKeyILASTSKFBINHKG-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.00
Rot. Bonds1

About N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide

N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide (PubChem CID 113255358) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide
PubChem CID113255358
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide
SMILESCC1(C)CCCCC1NC(=O)N1CCOCC1
InChIInChI=1S/C13H24N2O2/c1-13(2)6-4-3-5-11(13)14-12(16)15-7-9-17-10-8-15/h11H,3-10H2,1-2H3,(H,14,16)
InChIKeyILASTSKFBINHKG-UHFFFAOYSA-N
XLogP2.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide?
The IUPAC name of N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide (CID 113255358) is N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide?
The canonical SMILES for N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide is CC1(C)CCCCC1NC(=O)N1CCOCC1.
What is the InChIKey of N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide?
The InChIKey is ILASTSKFBINHKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-13(2)6-4-3-5-11(13)14-12(16)15-7-9-17-10-8-15/h11H,3-10H2,1-2H3,(H,14,16).
What are the key properties of N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide?
N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide is sourced from PubChem (CID 113255358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).