(3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone

C13H23NO2 — CID 79077097

IUPAC(3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone
SMILESCC1CCCC(C(=O)C2CN(C)CCO2)C1
InChIInChI=1S/C13H23NO2/c1-10-4-3-5-11(8-10)13(15)12-9-14(2)6-7-16-12/h10-12H,3-9H2,1-2H3
InChIKeyCFMXUSCSYQRGGE-UHFFFAOYSA-N
MW225.33 g/mol
LogP1.71
Rot. Bonds2

About (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone

(3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone (PubChem CID 79077097) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone.

Molecular Properties

Compound Name(3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone
PubChem CID79077097
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name(3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone
SMILESCC1CCCC(C(=O)C2CN(C)CCO2)C1
InChIInChI=1S/C13H23NO2/c1-10-4-3-5-11(8-10)13(15)12-9-14(2)6-7-16-12/h10-12H,3-9H2,1-2H3
InChIKeyCFMXUSCSYQRGGE-UHFFFAOYSA-N
XLogP1.71
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone?
The IUPAC name of (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone (CID 79077097) is (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone.
What is the SMILES notation for (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone?
The canonical SMILES for (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone is CC1CCCC(C(=O)C2CN(C)CCO2)C1.
What is the InChIKey of (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone?
The InChIKey is CFMXUSCSYQRGGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-10-4-3-5-11(8-10)13(15)12-9-14(2)6-7-16-12/h10-12H,3-9H2,1-2H3.
What are the key properties of (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone?
(3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone has a molecular weight of 225.33 g/mol, XLogP of 1.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylcyclohexyl)-(4-methylmorpholin-2-yl)methanone is sourced from PubChem (CID 79077097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).