2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide

C14H19NO4 — CID 114630957

IUPAC2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NC2CC(O)C2(C)C)c1O
InChIInChI=1S/C14H19NO4/c1-14(2)10(7-11(14)16)15-13(18)8-5-4-6-9(19-3)12(8)17/h4-6,10-11,16-17H,7H2,1-3H3,(H,15,18)
InChIKeyZAVKWCNDQURXEC-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.29
Rot. Bonds3

About 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide

2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide (PubChem CID 114630957) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide.

Molecular Properties

Compound Name2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide
PubChem CID114630957
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Name2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NC2CC(O)C2(C)C)c1O
InChIInChI=1S/C14H19NO4/c1-14(2)10(7-11(14)16)15-13(18)8-5-4-6-9(19-3)12(8)17/h4-6,10-11,16-17H,7H2,1-3H3,(H,15,18)
InChIKeyZAVKWCNDQURXEC-UHFFFAOYSA-N
XLogP1.29
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methoxy-3-nitrobenzamide
CID 114630935
2-hydroxy-3-methoxy-N-(5-methylpiperidin-3-yl)benzamide
CID 107585188
3-bromo-N-(3-hydroxy-2,2-dimethylcyclobutyl)-4-methoxybenzamide
CID 114629941
2-hydroxy-3-methoxy-N-(3-methylcyclohexyl)benzamide
CID 43244115
2-chloro-N-(3-hydroxy-2,2-dimethylcyclobutyl)pyridine-3-carboxamide
CID 114629328
2-fluoro-6-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)benzamide
CID 104956514
N-(2-aminocyclohexyl)-2-hydroxy-3-methoxybenzamide
CID 55149455
N-(3-hydroxy-2,2-dimethylcyclobutyl)quinoline-4-carboxamide
CID 114631332
2,3-dihydroxy-N'-(2-hydroxy-3-methoxybenzoyl)benzohydrazide
CID 24773714
2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3,5-diiodobenzamide
CID 114630704
2-hydroxy-3-methoxy-N-[(1-methylcyclobutyl)methyl]benzamide
CID 103738116
N-(2-aminocycloheptyl)-2-hydroxy-3-methoxybenzamide
CID 63257686

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide?
The IUPAC name of 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide (CID 114630957) is 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide.
What is the SMILES notation for 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide?
The canonical SMILES for 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide is COc1cccc(C(=O)NC2CC(O)C2(C)C)c1O.
What is the InChIKey of 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide?
The InChIKey is ZAVKWCNDQURXEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-14(2)10(7-11(14)16)15-13(18)8-5-4-6-9(19-3)12(8)17/h4-6,10-11,16-17H,7H2,1-3H3,(H,15,18).
What are the key properties of 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide?
2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide has a molecular weight of 265.31 g/mol, XLogP of 1.29, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxybenzamide is sourced from PubChem (CID 114630957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).