(1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone

C15H28N2O2 — CID 64550855

IUPAC(1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone
SMILESCCC1COC(C)CN1C(=O)C1(N)CCCC(C)C1
InChIInChI=1S/C15H28N2O2/c1-4-13-10-19-12(3)9-17(13)14(18)15(16)7-5-6-11(2)8-15/h11-13H,4-10,16H2,1-3H3
InChIKeyWGYABKSAPCXMOL-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.92
Rot. Bonds2

About (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone

(1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone (PubChem CID 64550855) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone
PubChem CID64550855
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name(1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone
SMILESCCC1COC(C)CN1C(=O)C1(N)CCCC(C)C1
InChIInChI=1S/C15H28N2O2/c1-4-13-10-19-12(3)9-17(13)14(18)15(16)7-5-6-11(2)8-15/h11-13H,4-10,16H2,1-3H3
InChIKeyWGYABKSAPCXMOL-UHFFFAOYSA-N
XLogP1.92
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone?
The IUPAC name of (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone (CID 64550855) is (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone.
What is the SMILES notation for (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone?
The canonical SMILES for (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone is CCC1COC(C)CN1C(=O)C1(N)CCCC(C)C1.
What is the InChIKey of (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone?
The InChIKey is WGYABKSAPCXMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-4-13-10-19-12(3)9-17(13)14(18)15(16)7-5-6-11(2)8-15/h11-13H,4-10,16H2,1-3H3.
What are the key properties of (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone?
(1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone has a molecular weight of 268.40 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 64550855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).