4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide

C11H15NO3 — CID 62334746

IUPAC4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide
SMILESCC(O)CN(C)C(=O)c1ccc(O)cc1
InChIInChI=1S/C11H15NO3/c1-8(13)7-12(2)11(15)9-3-5-10(14)6-4-9/h3-6,8,13-14H,7H2,1-2H3
InChIKeyWSVHZVKHDUSFGM-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.85
Rot. Bonds3

About 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide

4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide (PubChem CID 62334746) has the molecular formula C11H15NO3 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide
PubChem CID62334746
Molecular FormulaC11H15NO3
Molecular Weight209.25 g/mol
Exact Mass209.11
IUPAC Name4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide
SMILESCC(O)CN(C)C(=O)c1ccc(O)cc1
InChIInChI=1S/C11H15NO3/c1-8(13)7-12(2)11(15)9-3-5-10(14)6-4-9/h3-6,8,13-14H,7H2,1-2H3
InChIKeyWSVHZVKHDUSFGM-UHFFFAOYSA-N
XLogP0.85
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-[(2S)-2-hydroxypropyl]-N-methylbenzamide
CID 146272515
4-carbamothioyl-N-(2-hydroxypropyl)-N-methylbenzamide
CID 62336591
N-(2-hydroxypropyl)-N-methyl-4-(propan-2-yloxymethyl)benzamide
CID 55061167
N-(2-hydroxypropyl)-N-methyl-4-(2-methylpropoxy)benzamide
CID 55061119
2,5-dihydroxy-N-(2-hydroxypropyl)-N-methylbenzamide
CID 107722894
N-(2-chloro-3-methoxypropyl)-4-hydroxy-N-methylbenzamide
CID 63398005
N-(2-hydroxypropyl)-N-methyl-4-(propylamino)benzamide
CID 62335915
5-hydroxy-N-[(2R)-2-hydroxypropyl]-N-methylpyridine-3-carboxamide
CID 167850128
N-butan-2-yl-4-hydroxy-N-methylbenzamide
CID 43273177
N-(2-hydroxypropyl)-N-methyl-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 62334420
N-(2-hydroxypropyl)-N-methylquinoxaline-6-carboxamide
CID 62876403
4-chloro-3-fluoro-N-(2-hydroxypropyl)-N-methylbenzamide
CID 103876616

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide?
The IUPAC name of 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide (CID 62334746) is 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide.
What is the SMILES notation for 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide?
The canonical SMILES for 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide is CC(O)CN(C)C(=O)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide?
The InChIKey is WSVHZVKHDUSFGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-8(13)7-12(2)11(15)9-3-5-10(14)6-4-9/h3-6,8,13-14H,7H2,1-2H3.
What are the key properties of 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide?
4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide has a molecular weight of 209.25 g/mol, XLogP of 0.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-hydroxypropyl)-N-methylbenzamide is sourced from PubChem (CID 62334746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).