2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide

C10H12N2O3 — CID 135817975

IUPAC2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide
SMILESCOc1ccc(O)c(/C=N/CC(N)=O)c1
InChIInChI=1S/C10H12N2O3/c1-15-8-2-3-9(13)7(4-8)5-12-6-10(11)14/h2-5,13H,6H2,1H3,(H2,11,14)/b12-5+
InChIKeyJVXKTWGPPLJKTN-LFYBBSHMSA-N
MW208.22 g/mol
LogP0.31
Rot. Bonds4

About 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide

2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide (PubChem CID 135817975) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide
PubChem CID135817975
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide
SMILESCOc1ccc(O)c(/C=N/CC(N)=O)c1
InChIInChI=1S/C10H12N2O3/c1-15-8-2-3-9(13)7(4-8)5-12-6-10(11)14/h2-5,13H,6H2,1H3,(H2,11,14)/b12-5+
InChIKeyJVXKTWGPPLJKTN-LFYBBSHMSA-N
XLogP0.31
TPSA84.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-[[3-[(2-hydroxy-5-methoxyphenyl)methylideneamino]-2,2-dimethylpropyl]iminomethyl]-4-methoxyphenol
CID 137231962
4-methoxy-2-(2-sulfanylethyliminomethyl)phenol
CID 137210775
2-[[(2-hydroxy-5-methoxyphenyl)methylideneamino]oxymethoxyiminomethyl]-4-methoxyphenol
CID 136914415
(E)-3-(2-hydroxy-5-methoxyphenyl)prop-2-enamide
CID 55266805
2-[2-[4-[2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]ethylsulfanyl]butylsulfanyl]ethyliminomethyl]-4-methoxyphenol
CID 137082870
3-[[(2-hydroxy-5-methoxyphenyl)methylideneamino]methyl]-4,6-dimethyl-1H-pyridin-2-one
CID 135597134
4-methoxy-2-[(2-methylphenyl)methyliminomethyl]phenol
CID 135757890
2-[(3-chlorophenyl)methyliminomethyl]-4-methoxyphenol
CID 135595429
2-[[(2R)-2-(diethylamino)-2-phenylethyl]iminomethyl]-4-methoxyphenol
CID 135758257
2-[2-(4-bromophenyl)sulfanylethyliminomethyl]-4-methoxyphenol
CID 135596106
ethyl 3-(2-hydroxy-5-methoxyphenyl)prop-2-enoate
CID 85440976
acetic acid;2-[2-[(2-hydroxy-4-methoxyphenyl)methylideneamino]ethyliminomethyl]-5-methoxyphenol;manganese
CID 135509459

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide?
The IUPAC name of 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide (CID 135817975) is 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide?
The canonical SMILES for 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide is COc1ccc(O)c(/C=N/CC(N)=O)c1.
What is the InChIKey of 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide?
The InChIKey is JVXKTWGPPLJKTN-LFYBBSHMSA-N. The full InChI is InChI=1S/C10H12N2O3/c1-15-8-2-3-9(13)7(4-8)5-12-6-10(11)14/h2-5,13H,6H2,1H3,(H2,11,14)/b12-5+.
What are the key properties of 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide?
2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide has a molecular weight of 208.22 g/mol, XLogP of 0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 135817975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).