ethane;4-(4-methylpent-4-enyl)morpholine

C12H25NO — CID 143794926

IUPACethane;4-(4-methylpent-4-enyl)morpholine
SMILESC=C(C)CCCN1CCOCC1.CC
InChIInChI=1S/C10H19NO.C2H6/c1-10(2)4-3-5-11-6-8-12-9-7-11;1-2/h1,3-9H2,2H3;1-2H3
InChIKeyLVJNSLKGMWBIMM-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.70
Rot. Bonds4

About ethane;4-(4-methylpent-4-enyl)morpholine

ethane;4-(4-methylpent-4-enyl)morpholine (PubChem CID 143794926) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is ethane;4-(4-methylpent-4-enyl)morpholine.

Molecular Properties

Compound Nameethane;4-(4-methylpent-4-enyl)morpholine
PubChem CID143794926
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Nameethane;4-(4-methylpent-4-enyl)morpholine
SMILESC=C(C)CCCN1CCOCC1.CC
InChIInChI=1S/C10H19NO.C2H6/c1-10(2)4-3-5-11-6-8-12-9-7-11;1-2/h1,3-9H2,2H3;1-2H3
InChIKeyLVJNSLKGMWBIMM-UHFFFAOYSA-N
XLogP2.70
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(2-Ethyl-1-butenyl)-morpholine
CID 329051
4-[4-(Trifluoromethyl)pent-4-enyl]morpholine
CID 146168644
2-Methyl-1-morpholino-1-pentene
CID 85679855
4-(2-Methyl-6-methyleneocta-1,7-dien-3-yl)morpholine
CID 137797150
4-(1,1,2,3,3-Pentafluoro-4-methylpent-4-enyl)morpholine
CID 134384157
4-(1,2-Difluoro-2,3-dimethylbut-3-enyl)morpholine
CID 134531081
4-Hex-5-enylmorpholine
CID 23437996
4-(3-Methyl-2-methylidenebut-3-en-1-yl)morpholine
CID 12933365
4-[(2E)-2-ethylidene-6-methylhept-5-enyl]morpholine
CID 49780955
1-(2-Prop-1-en-2-yloxyethyl)piperidine
CID 12607273
Morpholine, 4-(1,2-dimethyl-2-propenyl)-
CID 12616305
4-(3-Methylbut-3-enyl)morpholine
CID 13609252

Frequently Asked Questions

What is the IUPAC name of ethane;4-(4-methylpent-4-enyl)morpholine?
The IUPAC name of ethane;4-(4-methylpent-4-enyl)morpholine (CID 143794926) is ethane;4-(4-methylpent-4-enyl)morpholine.
What is the SMILES notation for ethane;4-(4-methylpent-4-enyl)morpholine?
The canonical SMILES for ethane;4-(4-methylpent-4-enyl)morpholine is C=C(C)CCCN1CCOCC1.CC.
What is the InChIKey of ethane;4-(4-methylpent-4-enyl)morpholine?
The InChIKey is LVJNSLKGMWBIMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO.C2H6/c1-10(2)4-3-5-11-6-8-12-9-7-11;1-2/h1,3-9H2,2H3;1-2H3.
What are the key properties of ethane;4-(4-methylpent-4-enyl)morpholine?
ethane;4-(4-methylpent-4-enyl)morpholine has a molecular weight of 199.34 g/mol, XLogP of 2.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-(4-methylpent-4-enyl)morpholine is sourced from PubChem (CID 143794926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).