ethane;3-(2-methylprop-2-enyl)morpholine

C10H21NO — CID 145307292

IUPACethane;3-(2-methylprop-2-enyl)morpholine
SMILESC=C(C)CC1COCCN1.CC
InChIInChI=1S/C8H15NO.C2H6/c1-7(2)5-8-6-10-4-3-9-8;1-2/h8-9H,1,3-6H2,2H3;1-2H3
InChIKeyZGROCVHEJUFFJY-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.97
Rot. Bonds2

About ethane;3-(2-methylprop-2-enyl)morpholine

ethane;3-(2-methylprop-2-enyl)morpholine (PubChem CID 145307292) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is ethane;3-(2-methylprop-2-enyl)morpholine.

Molecular Properties

Compound Nameethane;3-(2-methylprop-2-enyl)morpholine
PubChem CID145307292
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Nameethane;3-(2-methylprop-2-enyl)morpholine
SMILESC=C(C)CC1COCCN1.CC
InChIInChI=1S/C8H15NO.C2H6/c1-7(2)5-8-6-10-4-3-9-8;1-2/h8-9H,1,3-6H2,2H3;1-2H3
InChIKeyZGROCVHEJUFFJY-UHFFFAOYSA-N
XLogP1.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze ethane;3-(2-methylprop-2-enyl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-4-methyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-amine
CID 103215713
N,4-dimethyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-amine
CID 103215717
4-methyl-N-propyl-1-(2,2,2-trifluoroethoxy)pent-4-en-2-amine
CID 103215719
N-ethyl-4-methyl-1-(2,2,3,3-tetrafluoropropoxy)pent-4-en-2-amine
CID 103475860
4-methyl-N-propyl-1-(2,2,3,3-tetrafluoropropoxy)pent-4-en-2-amine
CID 103475971
3-(5,5,5-Trifluoro-2-methylpent-2-enyl)morpholine
CID 104855448
3-(6,6,6-Trifluoro-2-methylhex-2-enyl)morpholine
CID 104855458
3-(2-Fluoro-2-methylbut-3-enyl)morpholine
CID 116011239
3-(2-Fluoro-2,4-dimethylpent-3-enyl)morpholine
CID 116011290
3-(2-Fluoro-2,3-dimethylbut-3-enyl)morpholine
CID 116011342
N-(2-methoxyethyl)-4-methylidenecyclohexan-1-amine
CID 58902699
N-but-3-enyloxan-3-amine
CID 64313076

Frequently Asked Questions

What is the IUPAC name of ethane;3-(2-methylprop-2-enyl)morpholine?
The IUPAC name of ethane;3-(2-methylprop-2-enyl)morpholine (CID 145307292) is ethane;3-(2-methylprop-2-enyl)morpholine.
What is the SMILES notation for ethane;3-(2-methylprop-2-enyl)morpholine?
The canonical SMILES for ethane;3-(2-methylprop-2-enyl)morpholine is C=C(C)CC1COCCN1.CC.
What is the InChIKey of ethane;3-(2-methylprop-2-enyl)morpholine?
The InChIKey is ZGROCVHEJUFFJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.C2H6/c1-7(2)5-8-6-10-4-3-9-8;1-2/h8-9H,1,3-6H2,2H3;1-2H3.
What are the key properties of ethane;3-(2-methylprop-2-enyl)morpholine?
ethane;3-(2-methylprop-2-enyl)morpholine has a molecular weight of 171.28 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-(2-methylprop-2-enyl)morpholine is sourced from PubChem (CID 145307292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).