1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one

C16H29NO2 — CID 79044965

IUPAC1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one
SMILESCCC1CCCCC1C(=O)C(C)(C)N1CCOCC1
InChIInChI=1S/C16H29NO2/c1-4-13-7-5-6-8-14(13)15(18)16(2,3)17-9-11-19-12-10-17/h13-14H,4-12H2,1-3H3
InChIKeySFMYYRDDEXYXSC-UHFFFAOYSA-N
MW267.41 g/mol
LogP2.88
Rot. Bonds4

About 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one

1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one (PubChem CID 79044965) has the molecular formula C16H29NO2 and a molecular weight of 267.41 g/mol. Its IUPAC name is 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one
PubChem CID79044965
Molecular FormulaC16H29NO2
Molecular Weight267.41 g/mol
Exact Mass267.22
IUPAC Name1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one
SMILESCCC1CCCCC1C(=O)C(C)(C)N1CCOCC1
InChIInChI=1S/C16H29NO2/c1-4-13-7-5-6-8-14(13)15(18)16(2,3)17-9-11-19-12-10-17/h13-14H,4-12H2,1-3H3
InChIKeySFMYYRDDEXYXSC-UHFFFAOYSA-N
XLogP2.88
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.41
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-cyclopropyl-1-(2-ethylcyclohexyl)propan-1-one
CID 116558390
1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-ol
CID 79045058
2-methyl-1-(oxan-4-yl)-2-pyrrolidin-1-ylpropan-1-one
CID 79056188
2-ethyl-N-(2-methyl-2-morpholin-4-ylpropyl)cyclopentan-1-amine
CID 113259806
(2-ethylcyclohexyl)-(oxan-3-yl)methanone
CID 65331736
N-hydroxy-2-methyl-2-morpholin-4-ylpropanamide
CID 127000284
3-cyclopentyl-1-(2-ethylcyclohexyl)propan-1-one
CID 114973791
ethyl 2-methyl-2-morpholin-4-ylpropanoate
CID 13022015
oxan-2-yl (2S)-2-ethylcyclohexane-1-carboxylate
CID 59918644
(2S)-2-ethylcyclopentane-1-carboxylic acid
CID 59114270
2-methyl-2-morpholin-4-ylpropanoyl iodide
CID 155067930
2-methyl-2-morpholin-4-ylpropanoate
CID 25219445

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one?
The IUPAC name of 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one (CID 79044965) is 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one?
The canonical SMILES for 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one is CCC1CCCCC1C(=O)C(C)(C)N1CCOCC1.
What is the InChIKey of 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one?
The InChIKey is SFMYYRDDEXYXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO2/c1-4-13-7-5-6-8-14(13)15(18)16(2,3)17-9-11-19-12-10-17/h13-14H,4-12H2,1-3H3.
What are the key properties of 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one?
1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one has a molecular weight of 267.41 g/mol, XLogP of 2.88, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 79044965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).