4-amino-2-(2-hydroxypropoxy)benzamide

C10H14N2O3 — CID 106955593

IUPAC4-amino-2-(2-hydroxypropoxy)benzamide
SMILESCC(O)COc1cc(N)ccc1C(N)=O
InChIInChI=1S/C10H14N2O3/c1-6(13)5-15-9-4-7(11)2-3-8(9)10(12)14/h2-4,6,13H,5,11H2,1H3,(H2,12,14)
InChIKeyPUOKWGIKWIWYOL-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.13
Rot. Bonds4

About 4-amino-2-(2-hydroxypropoxy)benzamide

4-amino-2-(2-hydroxypropoxy)benzamide (PubChem CID 106955593) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 4-amino-2-(2-hydroxypropoxy)benzamide.

Molecular Properties

Compound Name4-amino-2-(2-hydroxypropoxy)benzamide
PubChem CID106955593
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name4-amino-2-(2-hydroxypropoxy)benzamide
SMILESCC(O)COc1cc(N)ccc1C(N)=O
InChIInChI=1S/C10H14N2O3/c1-6(13)5-15-9-4-7(11)2-3-8(9)10(12)14/h2-4,6,13H,5,11H2,1H3,(H2,12,14)
InChIKeyPUOKWGIKWIWYOL-UHFFFAOYSA-N
XLogP0.13
TPSA98.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-amino-2-propan-2-yloxybenzamide
CID 53495725
4-amino-2-[2-(1-methoxypropan-2-ylamino)-2-oxoethoxy]benzamide
CID 106955522
4-amino-2-(ethoxymethoxy)benzamide
CID 106955437
4-amino-2-[3-oxo-3-(propan-2-ylamino)propoxy]benzamide
CID 106955525
5-amino-2-(2-methoxypropoxy)benzamide
CID 106956252
methyl 4-amino-2-(3-amino-2-methyl-3-oxopropoxy)benzoate
CID 106954975
4-amino-2-(5-amino-5-oxopentoxy)benzamide
CID 114281709
4-amino-2-[2-(dimethylamino)-2-methylpropoxy]benzamide
CID 79679565
4-amino-2-(5-hydroxypentoxy)benzamide
CID 106955432
5-amino-2-(2-methylpentoxy)benzamide
CID 103284499
methyl 4-amino-2-(3-hydroxy-2-methylpropoxy)benzoate
CID 106955001
1-[2-(2-hydroxypropoxy)-4-methylphenyl]ethanone
CID 63651270

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(2-hydroxypropoxy)benzamide?
The IUPAC name of 4-amino-2-(2-hydroxypropoxy)benzamide (CID 106955593) is 4-amino-2-(2-hydroxypropoxy)benzamide.
What is the SMILES notation for 4-amino-2-(2-hydroxypropoxy)benzamide?
The canonical SMILES for 4-amino-2-(2-hydroxypropoxy)benzamide is CC(O)COc1cc(N)ccc1C(N)=O.
What is the InChIKey of 4-amino-2-(2-hydroxypropoxy)benzamide?
The InChIKey is PUOKWGIKWIWYOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6(13)5-15-9-4-7(11)2-3-8(9)10(12)14/h2-4,6,13H,5,11H2,1H3,(H2,12,14).
What are the key properties of 4-amino-2-(2-hydroxypropoxy)benzamide?
4-amino-2-(2-hydroxypropoxy)benzamide has a molecular weight of 210.23 g/mol, XLogP of 0.13, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(2-hydroxypropoxy)benzamide is sourced from PubChem (CID 106955593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).