3-[(2-hydroxyphenyl)methylamino]benzamide

C14H14N2O2 — CID 28650539

IUPAC3-[(2-hydroxyphenyl)methylamino]benzamide
SMILESNC(=O)c1cccc(NCc2ccccc2O)c1
InChIInChI=1S/C14H14N2O2/c15-14(18)10-5-3-6-12(8-10)16-9-11-4-1-2-7-13(11)17/h1-8,16-17H,9H2,(H2,15,18)
InChIKeyOQUQIUGCVFINHM-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.10
Rot. Bonds4

About 3-[(2-hydroxyphenyl)methylamino]benzamide

3-[(2-hydroxyphenyl)methylamino]benzamide (PubChem CID 28650539) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 3-[(2-hydroxyphenyl)methylamino]benzamide.

Molecular Properties

Compound Name3-[(2-hydroxyphenyl)methylamino]benzamide
PubChem CID28650539
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name3-[(2-hydroxyphenyl)methylamino]benzamide
SMILESNC(=O)c1cccc(NCc2ccccc2O)c1
InChIInChI=1S/C14H14N2O2/c15-14(18)10-5-3-6-12(8-10)16-9-11-4-1-2-7-13(11)17/h1-8,16-17H,9H2,(H2,15,18)
InChIKeyOQUQIUGCVFINHM-UHFFFAOYSA-N
XLogP2.10
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

3-[[2-(trifluoromethyl)phenyl]methylamino]benzamide
CID 28650471
[3-[(2-hydroxyphenyl)methylamino]phenyl]urea
CID 43744546
3-(1H-indol-3-ylmethylamino)benzamide
CID 60680190
3-[(2,4,5-trimethylphenyl)methylamino]benzamide
CID 43767609
3-[(3-chloro-2-fluorophenyl)methylamino]benzamide
CID 115743478
3-(quinolin-4-ylmethylamino)benzamide
CID 63868510
2-chloro-4-[(2-hydroxyphenyl)methylamino]benzamide
CID 43736451
3-[(4-iodophenyl)methylamino]benzamide
CID 107811157
3-(pyridin-4-ylmethylamino)benzamide
CID 28650520
3-[(4-fluorophenyl)methylamino]benzamide
CID 28650463
ethyl 3-[(2,3-dihydroxyphenyl)methylamino]benzoate
CID 61319901
2-[(3-fluoroanilino)methyl]phenol
CID 27267422

Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydroxyphenyl)methylamino]benzamide?
The IUPAC name of 3-[(2-hydroxyphenyl)methylamino]benzamide (CID 28650539) is 3-[(2-hydroxyphenyl)methylamino]benzamide.
What is the SMILES notation for 3-[(2-hydroxyphenyl)methylamino]benzamide?
The canonical SMILES for 3-[(2-hydroxyphenyl)methylamino]benzamide is NC(=O)c1cccc(NCc2ccccc2O)c1.
What is the InChIKey of 3-[(2-hydroxyphenyl)methylamino]benzamide?
The InChIKey is OQUQIUGCVFINHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c15-14(18)10-5-3-6-12(8-10)16-9-11-4-1-2-7-13(11)17/h1-8,16-17H,9H2,(H2,15,18).
What are the key properties of 3-[(2-hydroxyphenyl)methylamino]benzamide?
3-[(2-hydroxyphenyl)methylamino]benzamide has a molecular weight of 242.28 g/mol, XLogP of 2.10, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxyphenyl)methylamino]benzamide is sourced from PubChem (CID 28650539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).