ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide

C8H19NO4 — CID 143639153

IUPACethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide
SMILESCC.COC(CO)CNC(=O)CO
InChIInChI=1S/C6H13NO4.C2H6/c1-11-5(3-8)2-7-6(10)4-9;1-2/h5,8-9H,2-4H2,1H3,(H,7,10);1-2H3
InChIKeyMPJHKQJNPFYTFB-UHFFFAOYSA-N
MW193.24 g/mol
LogP-0.87
Rot. Bonds5

About ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide

ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide (PubChem CID 143639153) has the molecular formula C8H19NO4 and a molecular weight of 193.24 g/mol. Its IUPAC name is ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide.

Molecular Properties

Compound Nameethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide
PubChem CID143639153
Molecular FormulaC8H19NO4
Molecular Weight193.24 g/mol
Exact Mass193.13
IUPAC Nameethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide
SMILESCC.COC(CO)CNC(=O)CO
InChIInChI=1S/C6H13NO4.C2H6/c1-11-5(3-8)2-7-6(10)4-9;1-2/h5,8-9H,2-4H2,1H3,(H,7,10);1-2H3
InChIKeyMPJHKQJNPFYTFB-UHFFFAOYSA-N
XLogP-0.87
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.24
LogP ≤ 5-0.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-methoxy-3-(methylamino)propan-1-ol
CID 176680341
3-(ethylamino)-2-methoxypropan-1-ol
CID 135215408
ethane;2-methoxybutan-1-ol
CID 174440725
N-(2-amino-2-hydroxyethyl)-2-hydroxyacetamide
CID 146429713
4-(3-aminobutanoylamino)-3-methoxybutanoic acid
CID 103156918
3-chloro-2-methoxypropan-1-ol;ethane
CID 153379962
N-[2-methoxy-3-(prop-2-enoylamino)propyl]prop-2-enamide
CID 129044196
2-hydroxy-N-(2-methoxyethyl)acetamide
CID 19987818
N-(3-hydroxy-2-pentoxypropyl)hexanamide
CID 11832137
3-methoxy-4-[(2-methylsulfonylacetyl)amino]butanoic acid
CID 103153072
N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide
CID 106509940
N-(3-hydroxy-2-pentoxypropyl)dodecanamide
CID 10969961

Frequently Asked Questions

What is the IUPAC name of ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide?
The IUPAC name of ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide (CID 143639153) is ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide.
What is the SMILES notation for ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide?
The canonical SMILES for ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide is CC.COC(CO)CNC(=O)CO.
What is the InChIKey of ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide?
The InChIKey is MPJHKQJNPFYTFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO4.C2H6/c1-11-5(3-8)2-7-6(10)4-9;1-2/h5,8-9H,2-4H2,1H3,(H,7,10);1-2H3.
What are the key properties of ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide?
ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide has a molecular weight of 193.24 g/mol, XLogP of -0.87, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-hydroxy-N-(3-hydroxy-2-methoxypropyl)acetamide is sourced from PubChem (CID 143639153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).