ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol

C10H25NO3 — CID 156707108

IUPACethane;N-(1-ethoxypropan-2-yl)acetamide;methanol
SMILESCC.CCOCC(C)NC(C)=O.CO
InChIInChI=1S/C7H15NO2.C2H6.CH4O/c1-4-10-5-6(2)8-7(3)9;2*1-2/h6H,4-5H2,1-3H3,(H,8,9);1-2H3;2H,1H3
InChIKeyLCGZXRLQPNBGMC-UHFFFAOYSA-N
MW207.31 g/mol
LogP1.18
Rot. Bonds4

About ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol

ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol (PubChem CID 156707108) has the molecular formula C10H25NO3 and a molecular weight of 207.31 g/mol. Its IUPAC name is ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol.

Molecular Properties

Compound Nameethane;N-(1-ethoxypropan-2-yl)acetamide;methanol
PubChem CID156707108
Molecular FormulaC10H25NO3
Molecular Weight207.31 g/mol
Exact Mass207.18
IUPAC Nameethane;N-(1-ethoxypropan-2-yl)acetamide;methanol
SMILESCC.CCOCC(C)NC(C)=O.CO
InChIInChI=1S/C7H15NO2.C2H6.CH4O/c1-4-10-5-6(2)8-7(3)9;2*1-2/h6H,4-5H2,1-3H3,(H,8,9);1-2H3;2H,1H3
InChIKeyLCGZXRLQPNBGMC-UHFFFAOYSA-N
XLogP1.18
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.31
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(1-ethoxypropan-2-yl)propanamide
CID 78977149
N-(5-ethoxypentan-2-yl)acetamide
CID 89138295
N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide
CID 58153232
2-hydroxyethyl N-(1-ethoxypropan-2-yl)carbamate
CID 79348986
4-amino-N-(1-ethoxypropan-2-yl)-3-methylbutanamide
CID 81087723
N-(1-ethoxypropan-2-yl)benzamide
CID 47903637
1-(1-ethoxypropan-2-yl)-3-(2,2,2-trifluoroethyl)urea
CID 115592823
2-(1-ethoxypropan-2-ylcarbamoylamino)-2-ethylbutanoic acid
CID 79804072
1-amino-N-(1-ethoxypropan-2-yl)cyclobutane-1-carboxamide
CID 81168256
N-(4-bromobutan-2-yl)acetamide
CID 83179388
[(2S)-2-(ethoxycarbonylamino)propyl] acetate
CID 131844256
N-(1-ethoxypropan-2-yl)-4-iodobenzamide
CID 47903616

Frequently Asked Questions

What is the IUPAC name of ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol?
The IUPAC name of ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol (CID 156707108) is ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol.
What is the SMILES notation for ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol?
The canonical SMILES for ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol is CC.CCOCC(C)NC(C)=O.CO.
What is the InChIKey of ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol?
The InChIKey is LCGZXRLQPNBGMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2.C2H6.CH4O/c1-4-10-5-6(2)8-7(3)9;2*1-2/h6H,4-5H2,1-3H3,(H,8,9);1-2H3;2H,1H3.
What are the key properties of ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol?
ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol has a molecular weight of 207.31 g/mol, XLogP of 1.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(1-ethoxypropan-2-yl)acetamide;methanol is sourced from PubChem (CID 156707108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).