2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide

C11H15NO4 — CID 103748891

IUPAC2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide
SMILESCOCC(C)NC(=O)c1c(O)cccc1O
InChIInChI=1S/C11H15NO4/c1-7(6-16-2)12-11(15)10-8(13)4-3-5-9(10)14/h3-5,7,13-14H,6H2,1-2H3,(H,12,15)
InChIKeyCHXUXVUCJNEYDS-UHFFFAOYSA-N
MW225.24 g/mol
LogP0.86
Rot. Bonds4

About 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide

2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide (PubChem CID 103748891) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide.

Molecular Properties

Compound Name2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide
PubChem CID103748891
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide
SMILESCOCC(C)NC(=O)c1c(O)cccc1O
InChIInChI=1S/C11H15NO4/c1-7(6-16-2)12-11(15)10-8(13)4-3-5-9(10)14/h3-5,7,13-14H,6H2,1-2H3,(H,12,15)
InChIKeyCHXUXVUCJNEYDS-UHFFFAOYSA-N
XLogP0.86
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-bromo-3-methoxypropan-2-yl)-2,6-dihydroxybenzamide
CID 106184915
2,6-dihydroxy-N-pentan-2-ylbenzamide
CID 103890167
1-N,4-N-bis[(2R)-1-methoxypropan-2-yl]benzene-1,4-dicarboxamide
CID 25476067
2,6-dihydroxy-N-(2-methoxyethyl)benzamide
CID 103748859
2,4-dichloro-6-hydroxy-N-[(2S)-1-methoxypropan-2-yl]benzamide
CID 96525639
3-hydroxy-N-(1-methoxypropan-2-yl)naphthalene-2-carboxamide
CID 43403899
2,6-dihydroxy-N-pent-4-en-2-ylbenzamide
CID 103890504
N-heptan-2-yl-2,6-dihydroxybenzamide
CID 103748986
2,6-dihydroxy-N-(2-methoxyethoxy)benzamide
CID 103890596
N-(1-bromopropan-2-yl)-2-fluoro-6-hydroxybenzamide
CID 107016869
N-[(2S)-1-methoxypropan-2-yl]thiophene-2-carboxamide
CID 670280
3-bromo-2-chloro-N-(1-methoxypropan-2-yl)benzamide
CID 103975283

Frequently Asked Questions

What is the IUPAC name of 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide?
The IUPAC name of 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide (CID 103748891) is 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide.
What is the SMILES notation for 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide?
The canonical SMILES for 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide is COCC(C)NC(=O)c1c(O)cccc1O.
What is the InChIKey of 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide?
The InChIKey is CHXUXVUCJNEYDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-7(6-16-2)12-11(15)10-8(13)4-3-5-9(10)14/h3-5,7,13-14H,6H2,1-2H3,(H,12,15).
What are the key properties of 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide?
2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide has a molecular weight of 225.24 g/mol, XLogP of 0.86, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dihydroxy-N-(1-methoxypropan-2-yl)benzamide is sourced from PubChem (CID 103748891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).