2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone

C15H28N2O2 — CID 95155737

IUPAC2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone
SMILESCCN(CC(=O)N1CCO[C@@H](C)C1)C1CCCCC1
InChIInChI=1S/C15H28N2O2/c1-3-16(14-7-5-4-6-8-14)12-15(18)17-9-10-19-13(2)11-17/h13-14H,3-12H2,1-2H3/t13-/m0/s1
InChIKeyWPCCFRZEKPLRHV-ZDUSSCGKSA-N
MW268.40 g/mol
LogP1.89
Rot. Bonds4

About 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone

2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone (PubChem CID 95155737) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone
PubChem CID95155737
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone
SMILESCCN(CC(=O)N1CCO[C@@H](C)C1)C1CCCCC1
InChIInChI=1S/C15H28N2O2/c1-3-16(14-7-5-4-6-8-14)12-15(18)17-9-10-19-13(2)11-17/h13-14H,3-12H2,1-2H3/t13-/m0/s1
InChIKeyWPCCFRZEKPLRHV-ZDUSSCGKSA-N
XLogP1.89
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone?
The IUPAC name of 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone (CID 95155737) is 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone.
What is the SMILES notation for 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone?
The canonical SMILES for 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone is CCN(CC(=O)N1CCO[C@@H](C)C1)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone?
The InChIKey is WPCCFRZEKPLRHV-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-16(14-7-5-4-6-8-14)12-15(18)17-9-10-19-13(2)11-17/h13-14H,3-12H2,1-2H3/t13-/m0/s1.
What are the key properties of 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone?
2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone has a molecular weight of 268.40 g/mol, XLogP of 1.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(ethyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone is sourced from PubChem (CID 95155737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).