3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine

C15H29NO — CID 113462306

IUPAC3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine
SMILESCCCCC(/C=C(/C)CC1COCCN1)CC
InChIInChI=1S/C15H29NO/c1-4-6-7-14(5-2)10-13(3)11-15-12-17-9-8-16-15/h10,14-16H,4-9,11-12H2,1-3H3/b13-10-
InChIKeyGTWBBGLCRLOMBT-RAXLEYEMSA-N
MW239.40 g/mol
LogP3.53
Rot. Bonds7

About 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine

3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine (PubChem CID 113462306) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine.

Molecular Properties

Compound Name3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine
PubChem CID113462306
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine
SMILESCCCCC(/C=C(/C)CC1COCCN1)CC
InChIInChI=1S/C15H29NO/c1-4-6-7-14(5-2)10-13(3)11-15-12-17-9-8-16-15/h10,14-16H,4-9,11-12H2,1-3H3/b13-10-
InChIKeyGTWBBGLCRLOMBT-RAXLEYEMSA-N
XLogP3.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-morpholin-3-yl-N-octan-4-ylacetamide
CID 114138382
3-[2-methyl-3-(oxolan-2-yl)prop-2-enyl]morpholine
CID 104855441
3-(2,3-dimethylhex-2-enyl)morpholine
CID 107889216
2-morpholin-3-yl-N-octylacetamide
CID 113337235
(2S)-1-[(3S)-morpholin-3-yl]-4-propylheptan-2-ol
CID 10955779
N-(2-methylprop-2-enyl)-2-morpholin-3-ylacetamide
CID 114617037
3-(2-methylpropyl)morpholine
CID 20811826
N-methyl-1-morpholin-3-ylbutan-2-amine
CID 116956752
1-morpholin-3-ylpentan-2-imine;dihydrochloride
CID 174268999
(2E,4R,6E,8S)-4,8-diethyl-6-methyldodeca-2,6-dien-1-ol
CID 46189708
3-[(Z)-3-(3,4-dichlorophenyl)-2-methylprop-2-enyl]morpholine
CID 113462311
2-[(3S)-morpholin-3-yl]acetamide
CID 96824646

Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine?
The IUPAC name of 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine (CID 113462306) is 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine.
What is the SMILES notation for 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine?
The canonical SMILES for 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine is CCCCC(/C=C(/C)CC1COCCN1)CC.
What is the InChIKey of 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine?
The InChIKey is GTWBBGLCRLOMBT-RAXLEYEMSA-N. The full InChI is InChI=1S/C15H29NO/c1-4-6-7-14(5-2)10-13(3)11-15-12-17-9-8-16-15/h10,14-16H,4-9,11-12H2,1-3H3/b13-10-.
What are the key properties of 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine?
3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine has a molecular weight of 239.40 g/mol, XLogP of 3.53, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-4-ethyl-2-methyloct-2-enyl]morpholine is sourced from PubChem (CID 113462306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).