ethane;1-[ethyl(methyl)amino]propan-2-one

C8H19NO — CID 142250702

IUPACethane;1-[ethyl(methyl)amino]propan-2-one
SMILESCC.CCN(C)CC(C)=O
InChIInChI=1S/C6H13NO.C2H6/c1-4-7(3)5-6(2)8;1-2/h4-5H2,1-3H3;1-2H3
InChIKeyHDNGOOGGPVXCTE-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.55
Rot. Bonds3

About ethane;1-[ethyl(methyl)amino]propan-2-one

ethane;1-[ethyl(methyl)amino]propan-2-one (PubChem CID 142250702) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is ethane;1-[ethyl(methyl)amino]propan-2-one.

Molecular Properties

Compound Nameethane;1-[ethyl(methyl)amino]propan-2-one
PubChem CID142250702
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Nameethane;1-[ethyl(methyl)amino]propan-2-one
SMILESCC.CCN(C)CC(C)=O
InChIInChI=1S/C6H13NO.C2H6/c1-4-7(3)5-6(2)8;1-2/h4-5H2,1-3H3;1-2H3
InChIKeyHDNGOOGGPVXCTE-UHFFFAOYSA-N
XLogP1.55
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[butyl(methyl)amino]propan-2-one
CID 43219631
1-[bis(2-oxopropyl)amino]propan-2-one;hydrate
CID 88695571
butan-2-one;N,N-dimethylmethanamine;ethane
CID 159619561
N-ethyl-N-methylacetamide;N-methyl-N-(2-oxopropyl)acetamide
CID 158566943
1-(diethylamino)propan-2-one;sulfuric acid
CID 87420843
2-[ethyl(2-oxopropyl)amino]acetamide
CID 103103058
2-[2-[methyl(2-oxopropyl)amino]ethyl-propylamino]acetic acid
CID 156737158
2-[ethyl-[2-[ethyl(2-oxopropyl)amino]ethyl]amino]acetic acid
CID 134601961
1-[ethyl(methyl)amino]-3,3-dimethylbutan-2-one
CID 43794888
ethane;1-[methyl(propan-2-yl)amino]propan-2-one
CID 178033962
ethane;N-ethyl-N-methylethanamine;propane
CID 170620045
butan-2-one;ethane
CID 158905935

Frequently Asked Questions

What is the IUPAC name of ethane;1-[ethyl(methyl)amino]propan-2-one?
The IUPAC name of ethane;1-[ethyl(methyl)amino]propan-2-one (CID 142250702) is ethane;1-[ethyl(methyl)amino]propan-2-one.
What is the SMILES notation for ethane;1-[ethyl(methyl)amino]propan-2-one?
The canonical SMILES for ethane;1-[ethyl(methyl)amino]propan-2-one is CC.CCN(C)CC(C)=O.
What is the InChIKey of ethane;1-[ethyl(methyl)amino]propan-2-one?
The InChIKey is HDNGOOGGPVXCTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.C2H6/c1-4-7(3)5-6(2)8;1-2/h4-5H2,1-3H3;1-2H3.
What are the key properties of ethane;1-[ethyl(methyl)amino]propan-2-one?
ethane;1-[ethyl(methyl)amino]propan-2-one has a molecular weight of 145.25 g/mol, XLogP of 1.55, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-[ethyl(methyl)amino]propan-2-one is sourced from PubChem (CID 142250702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).