ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide

C16H34N2O2 — CID 144624907

IUPACethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide
SMILESCC.CC.CC1CCC(NC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H22N2O2.2C2H6/c1-10-2-4-11(5-3-10)13-12(15)14-6-8-16-9-7-14;2*1-2/h10-11H,2-9H2,1H3,(H,13,15);2*1-2H3
InChIKeyWXOQGQKNCKWCDX-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.66
Rot. Bonds1

About ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide

ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide (PubChem CID 144624907) has the molecular formula C16H34N2O2 and a molecular weight of 286.46 g/mol. Its IUPAC name is ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide.

Molecular Properties

Compound Nameethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide
PubChem CID144624907
Molecular FormulaC16H34N2O2
Molecular Weight286.46 g/mol
Exact Mass286.26
IUPAC Nameethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide
SMILESCC.CC.CC1CCC(NC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H22N2O2.2C2H6/c1-10-2-4-11(5-3-10)13-12(15)14-6-8-16-9-7-14;2*1-2/h10-11H,2-9H2,1H3,(H,13,15);2*1-2H3
InChIKeyWXOQGQKNCKWCDX-UHFFFAOYSA-N
XLogP3.66
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide?
The IUPAC name of ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide (CID 144624907) is ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide.
What is the SMILES notation for ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide?
The canonical SMILES for ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide is CC.CC.CC1CCC(NC(=O)N2CCOCC2)CC1.
What is the InChIKey of ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide?
The InChIKey is WXOQGQKNCKWCDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2.2C2H6/c1-10-2-4-11(5-3-10)13-12(15)14-6-8-16-9-7-14;2*1-2/h10-11H,2-9H2,1H3,(H,13,15);2*1-2H3.
What are the key properties of ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide?
ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide has a molecular weight of 286.46 g/mol, XLogP of 3.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(4-methylcyclohexyl)morpholine-4-carboxamide is sourced from PubChem (CID 144624907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).