ethenone;N-ethyl-N-propan-2-ylpropan-2-amine

C10H21NO — CID 91070858

IUPACethenone;N-ethyl-N-propan-2-ylpropan-2-amine
SMILESC=C=O.CCN(C(C)C)C(C)C
InChIInChI=1S/C8H19N.C2H2O/c1-6-9(7(2)3)8(4)5;1-2-3/h7-8H,6H2,1-5H3;1H2
InChIKeyDVVNOEPDHVBQNA-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.13
Rot. Bonds3

About ethenone;N-ethyl-N-propan-2-ylpropan-2-amine

ethenone;N-ethyl-N-propan-2-ylpropan-2-amine (PubChem CID 91070858) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is ethenone;N-ethyl-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound Nameethenone;N-ethyl-N-propan-2-ylpropan-2-amine
PubChem CID91070858
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Nameethenone;N-ethyl-N-propan-2-ylpropan-2-amine
SMILESC=C=O.CCN(C(C)C)C(C)C
InChIInChI=1S/C8H19N.C2H2O/c1-6-9(7(2)3)8(4)5;1-2-3/h7-8H,6H2,1-5H3;1H2
InChIKeyDVVNOEPDHVBQNA-UHFFFAOYSA-N
XLogP2.13
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-N-(1,2,3-13C3)propan-2-yl(1,2,3-13C3)propan-2-amine
CID 71309796
Lithium diisopropylethylamine
CID 86615685
N-ethyl-N-propan-2-ylpropan-2-amine;trihydrofluoride
CID 45108321
bis(N-ethyl-N-propan-2-ylpropan-2-amine);hydrofluoride
CID 159245549
magnesium;N-ethyl-N-propan-2-ylpropan-2-amine;dichloride
CID 174345193
sodium;N-ethyl-N-propan-2-ylpropan-2-amine;hydride
CID 159603940
sodium;N-ethyl-N-propan-2-ylpropan-2-amine;iodide
CID 174682450
N-ethyl-N-propan-2-ylpropan-2-amine;propan-2-ol
CID 159144844
dihydroxy(oxo)phosphanium;N-ethyl-N-propan-2-ylpropan-2-amine
CID 139533112
ethanol;N-ethyl-N-propan-2-ylpropan-2-amine;hydrate
CID 87772214
acetamide;N-ethyl-N-propan-2-ylpropan-2-amine
CID 158250626
dipotassium;N-ethyl-N-propan-2-ylpropan-2-amine;carbonate
CID 159108384

Frequently Asked Questions

What is the IUPAC name of ethenone;N-ethyl-N-propan-2-ylpropan-2-amine?
The IUPAC name of ethenone;N-ethyl-N-propan-2-ylpropan-2-amine (CID 91070858) is ethenone;N-ethyl-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for ethenone;N-ethyl-N-propan-2-ylpropan-2-amine?
The canonical SMILES for ethenone;N-ethyl-N-propan-2-ylpropan-2-amine is C=C=O.CCN(C(C)C)C(C)C.
What is the InChIKey of ethenone;N-ethyl-N-propan-2-ylpropan-2-amine?
The InChIKey is DVVNOEPDHVBQNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.C2H2O/c1-6-9(7(2)3)8(4)5;1-2-3/h7-8H,6H2,1-5H3;1H2.
What are the key properties of ethenone;N-ethyl-N-propan-2-ylpropan-2-amine?
ethenone;N-ethyl-N-propan-2-ylpropan-2-amine has a molecular weight of 171.28 g/mol, XLogP of 2.13, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenone;N-ethyl-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 91070858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).