2-(4-hydroxyphenyl)acetamide;dihydrate

C8H13NO4 — CID 174796457

IUPAC2-(4-hydroxyphenyl)acetamide;dihydrate
SMILESNC(=O)Cc1ccc(O)cc1.O.O
InChIInChI=1S/C8H9NO2.2H2O/c9-8(11)5-6-1-3-7(10)4-2-6;;/h1-4,10H,5H2,(H2,9,11);2*1H2
InChIKeyGAFWOQCRZYVPFB-UHFFFAOYSA-N
MW187.20 g/mol
LogP-1.23
Rot. Bonds2

About 2-(4-hydroxyphenyl)acetamide;dihydrate

2-(4-hydroxyphenyl)acetamide;dihydrate (PubChem CID 174796457) has the molecular formula C8H13NO4 and a molecular weight of 187.20 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)acetamide;dihydrate.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)acetamide;dihydrate
PubChem CID174796457
Molecular FormulaC8H13NO4
Molecular Weight187.20 g/mol
Exact Mass187.08
IUPAC Name2-(4-hydroxyphenyl)acetamide;dihydrate
SMILESNC(=O)Cc1ccc(O)cc1.O.O
InChIInChI=1S/C8H9NO2.2H2O/c9-8(11)5-6-1-3-7(10)4-2-6;;/h1-4,10H,5H2,(H2,9,11);2*1H2
InChIKeyGAFWOQCRZYVPFB-UHFFFAOYSA-N
XLogP-1.23
TPSA126.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 5-1.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-hydroxyphenyl)acetamide;sulfuric acid
CID 155147372
1,3-bis(4-hydroxyphenyl)propan-2-one
CID 159297209
4-(2-aminoprop-2-enyl)phenol;carbonic acid
CID 158851238
2-[4-(2-aminoethyl)phenyl]acetamide
CID 70268423
sodium 2-(4-hydroxyphenyl)acetate
CID 23664575
1-(4-hydroxyphenyl)propan-2-one
CID 7019274
4-(2-aminoprop-2-enyl)phenol
CID 20758770
2-[4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]phenyl]acetamide
CID 68956435
(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate
CID 141285444
(4-hydroxyphenyl)methyl hydrogen carbonate
CID 19956654
benzene-1,4-diol;carbamic acid
CID 158152403
(2E,4E)-dodeca-2,4-diene;2-(4-hydroxyphenyl)acetamide
CID 118377657

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)acetamide;dihydrate?
The IUPAC name of 2-(4-hydroxyphenyl)acetamide;dihydrate (CID 174796457) is 2-(4-hydroxyphenyl)acetamide;dihydrate.
What is the SMILES notation for 2-(4-hydroxyphenyl)acetamide;dihydrate?
The canonical SMILES for 2-(4-hydroxyphenyl)acetamide;dihydrate is NC(=O)Cc1ccc(O)cc1.O.O.
What is the InChIKey of 2-(4-hydroxyphenyl)acetamide;dihydrate?
The InChIKey is GAFWOQCRZYVPFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2.2H2O/c9-8(11)5-6-1-3-7(10)4-2-6;;/h1-4,10H,5H2,(H2,9,11);2*1H2.
What are the key properties of 2-(4-hydroxyphenyl)acetamide;dihydrate?
2-(4-hydroxyphenyl)acetamide;dihydrate has a molecular weight of 187.20 g/mol, XLogP of -1.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)acetamide;dihydrate is sourced from PubChem (CID 174796457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).