4-(aminomethyl)-N-hydroxybenzamide

C8H10N2O2 — CID 63992786

IUPAC4-(aminomethyl)-N-hydroxybenzamide
SMILESNCc1ccc(C(=O)NO)cc1
InChIInChI=1S/C8H10N2O2/c9-5-6-1-3-7(4-2-6)8(11)10-12/h1-4,12H,5,9H2,(H,10,11)
InChIKeyBEFFEYYOJBJYKA-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.26
Rot. Bonds2

About 4-(aminomethyl)-N-hydroxybenzamide

4-(aminomethyl)-N-hydroxybenzamide (PubChem CID 63992786) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 4-(aminomethyl)-N-hydroxybenzamide.

Molecular Properties

Compound Name4-(aminomethyl)-N-hydroxybenzamide
PubChem CID63992786
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name4-(aminomethyl)-N-hydroxybenzamide
SMILESNCc1ccc(C(=O)NO)cc1
InChIInChI=1S/C8H10N2O2/c9-5-6-1-3-7(4-2-6)8(11)10-12/h1-4,12H,5,9H2,(H,10,11)
InChIKeyBEFFEYYOJBJYKA-UHFFFAOYSA-N
XLogP0.26
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Benzamide
CID 2331
Benzohydroxamic acid
CID 10313
4-Methylbenzamide
CID 69274
Carboxycinnamic Acid Bishydroxamide
CID 5353484
Terephthalamide
CID 76381
N-hydroxy-N-methylbenzamide
CID 371715
N-hydroxy-4-methylbenzamide
CID 426839
Isophthalamide
CID 74445
N-Hydroxy-4-iodobenzamide
CID 615643
4-Benzylbenzamide
CID 21920336
Biphenylhydroxamic acid
CID 44369716
p-Cyanobenzamide
CID 76427

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-hydroxybenzamide?
The IUPAC name of 4-(aminomethyl)-N-hydroxybenzamide (CID 63992786) is 4-(aminomethyl)-N-hydroxybenzamide.
What is the SMILES notation for 4-(aminomethyl)-N-hydroxybenzamide?
The canonical SMILES for 4-(aminomethyl)-N-hydroxybenzamide is NCc1ccc(C(=O)NO)cc1.
What is the InChIKey of 4-(aminomethyl)-N-hydroxybenzamide?
The InChIKey is BEFFEYYOJBJYKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c9-5-6-1-3-7(4-2-6)8(11)10-12/h1-4,12H,5,9H2,(H,10,11).
What are the key properties of 4-(aminomethyl)-N-hydroxybenzamide?
4-(aminomethyl)-N-hydroxybenzamide has a molecular weight of 166.18 g/mol, XLogP of 0.26, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-hydroxybenzamide is sourced from PubChem (CID 63992786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).