acetamide;1-ethoxyethanol

C6H15NO3 — CID 175470032

IUPACacetamide;1-ethoxyethanol
SMILESCC(N)=O.CCOC(C)O
InChIInChI=1S/C4H10O2.C2H5NO/c1-3-6-4(2)5;1-2(3)4/h4-5H,3H2,1-2H3;1H3,(H2,3,4)
InChIKeyNMTWCILSRLRABD-UHFFFAOYSA-N
MW149.19 g/mol
LogP-0.15
Rot. Bonds2

About acetamide;1-ethoxyethanol

acetamide;1-ethoxyethanol (PubChem CID 175470032) has the molecular formula C6H15NO3 and a molecular weight of 149.19 g/mol. Its IUPAC name is acetamide;1-ethoxyethanol.

Molecular Properties

Compound Nameacetamide;1-ethoxyethanol
PubChem CID175470032
Molecular FormulaC6H15NO3
Molecular Weight149.19 g/mol
Exact Mass149.11
IUPAC Nameacetamide;1-ethoxyethanol
SMILESCC(N)=O.CCOC(C)O
InChIInChI=1S/C4H10O2.C2H5NO/c1-3-6-4(2)5;1-2(3)4/h4-5H,3H2,1-2H3;1H3,(H2,3,4)
InChIKeyNMTWCILSRLRABD-UHFFFAOYSA-N
XLogP-0.15
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

ethanamine;1-ethoxyethanol
CID 20501270
CID 159597367
CID 159597367
strontium;1-ethoxyethanol;hydride
CID 174472576
1-ethoxyethanol;N-methylmethanamine
CID 18941772
ethyl acetate;propan-2-ol;hydrate
CID 22041847
1-(2-aminoethoxy)ethanol;1-ethoxyethanol
CID 157343406
ethyl acetate;bis(propan-2-ol)
CID 87186921
ethyl acetate;2-methylpropanamide
CID 174848751
4,4-diethoxy-2-methylbutanamide
CID 90312844
ethyl acetate;tetrahydrate
CID 173019761
ethyl acetate;octacontahydrate
CID 173077486
ethyl acetate;pentacontahydrate
CID 173010597

Frequently Asked Questions

What is the IUPAC name of acetamide;1-ethoxyethanol?
The IUPAC name of acetamide;1-ethoxyethanol (CID 175470032) is acetamide;1-ethoxyethanol.
What is the SMILES notation for acetamide;1-ethoxyethanol?
The canonical SMILES for acetamide;1-ethoxyethanol is CC(N)=O.CCOC(C)O.
What is the InChIKey of acetamide;1-ethoxyethanol?
The InChIKey is NMTWCILSRLRABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O2.C2H5NO/c1-3-6-4(2)5;1-2(3)4/h4-5H,3H2,1-2H3;1H3,(H2,3,4).
What are the key properties of acetamide;1-ethoxyethanol?
acetamide;1-ethoxyethanol has a molecular weight of 149.19 g/mol, XLogP of -0.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for acetamide;1-ethoxyethanol is sourced from PubChem (CID 175470032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).