ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine

C9H21NO — CID 142497540

IUPACethene;N-(2-methoxyethyl)-N-methylpropan-2-amine
SMILESC=C.COCCN(C)C(C)C
InChIInChI=1S/C7H17NO.C2H4/c1-7(2)8(3)5-6-9-4;1-2/h7H,5-6H2,1-4H3;1-2H2
InChIKeyCXURIYYCMWWZAJ-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.78
Rot. Bonds4

About ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine

ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine (PubChem CID 142497540) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine.

Molecular Properties

Compound Nameethene;N-(2-methoxyethyl)-N-methylpropan-2-amine
PubChem CID142497540
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Nameethene;N-(2-methoxyethyl)-N-methylpropan-2-amine
SMILESC=C.COCCN(C)C(C)C
InChIInChI=1S/C7H17NO.C2H4/c1-7(2)8(3)5-6-9-4;1-2/h7H,5-6H2,1-4H3;1-2H2
InChIKeyCXURIYYCMWWZAJ-UHFFFAOYSA-N
XLogP1.78
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.78
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

1-N,1-N'-bis(2-methoxyethyl)-1-N,1-N'-dimethylethane-1,1-diamine;prop-1-yne
CID 144530363
2-N-(2-methoxyethyl)-1-N,2-N-dimethylpropane-1,2-diamine
CID 62447079
3-N-(2-methoxyethyl)-3-N,2-dimethylbutane-1,3-diamine
CID 79409704
N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine
CID 170129105
2-N-(2-methoxyethyl)-2-N,3-dimethyl-1-N-propan-2-ylbutane-1,2-diamine
CID 62449333
3-[2-methoxyethyl(methyl)amino]-2-methylbutanoic acid
CID 79407111
3-methoxy-N-(2-methoxyethyl)-N-propan-2-ylpropan-1-amine
CID 177187385
ethene;N-(2-methoxyethyl)-N-methylpropan-1-amine
CID 143338989
1-N-tert-butyl-2-N-(2-methoxyethyl)-2-N-methylpropane-1,2-diamine
CID 62447273
N-(1-methoxypropan-2-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 62574091
ethene;N-ethyl-N-methylpropan-2-amine
CID 144977253
1-[bis(2-methoxyethyl)amino]propan-2-ol
CID 59693413

Frequently Asked Questions

What is the IUPAC name of ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine?
The IUPAC name of ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine (CID 142497540) is ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine.
What is the SMILES notation for ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine?
The canonical SMILES for ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine is C=C.COCCN(C)C(C)C.
What is the InChIKey of ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine?
The InChIKey is CXURIYYCMWWZAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO.C2H4/c1-7(2)8(3)5-6-9-4;1-2/h7H,5-6H2,1-4H3;1-2H2.
What are the key properties of ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine?
ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine has a molecular weight of 159.27 g/mol, XLogP of 1.78, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;N-(2-methoxyethyl)-N-methylpropan-2-amine is sourced from PubChem (CID 142497540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).