N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide

C15H24N2O3 — CID 115309726

IUPACN-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC(C)(CN)CC(C)C)c(O)c1
InChIInChI=1S/C15H24N2O3/c1-10(2)8-15(3,9-16)17-14(19)12-6-5-11(20-4)7-13(12)18/h5-7,10,18H,8-9,16H2,1-4H3,(H,17,19)
InChIKeyABGFEXWXKQMJNK-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.89
Rot. Bonds6

About N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide

N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide (PubChem CID 115309726) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide
PubChem CID115309726
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC(C)(CN)CC(C)C)c(O)c1
InChIInChI=1S/C15H24N2O3/c1-10(2)8-15(3,9-16)17-14(19)12-6-5-11(20-4)7-13(12)18/h5-7,10,18H,8-9,16H2,1-4H3,(H,17,19)
InChIKeyABGFEXWXKQMJNK-UHFFFAOYSA-N
XLogP1.89
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-amino-2,4-dimethylpentan-2-yl)-2,5-dihydroxybenzamide
CID 107725269
N-(1-amino-2,4-dimethylpentan-2-yl)-4-bromo-2-methoxybenzamide
CID 115369688
N-(1-chloro-2-methylbutan-2-yl)-2-hydroxy-4-methoxybenzamide
CID 114303621
N-(1-amino-2,4-dimethylpentan-2-yl)-5-bromo-2-hydroxybenzamide
CID 104872338
N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide
CID 107940162
N-(1-amino-2,4-dimethylpentan-2-yl)-5-(4-methoxyphenyl)pyridine-3-carboxamide;dihydrochloride
CID 119598143
N-[1-(tert-butylamino)-1-oxopropan-2-yl]-2-hydroxy-4-methoxybenzamide
CID 115595332
N-(1-amino-2,4-dimethylpentan-2-yl)-4-bromo-2-methylbenzamide;hydrochloride
CID 119598613
2-hydroxy-4-methoxy-N-(5-methylhexan-2-yl)benzamide
CID 43019441
N-(1-amino-2,4-dimethylpentan-2-yl)-2-methylbenzamide
CID 81487529
N-(1-amino-2,4-dimethylpentan-2-yl)-2,4,5-trifluoro-3-hydroxybenzamide
CID 115309822
N-(1-amino-2,4-dimethylpentan-2-yl)-2-bromo-4-chlorobenzamide;hydrochloride
CID 119599263

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide?
The IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide (CID 115309726) is N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide is COc1ccc(C(=O)NC(C)(CN)CC(C)C)c(O)c1.
What is the InChIKey of N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide?
The InChIKey is ABGFEXWXKQMJNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-10(2)8-15(3,9-16)17-14(19)12-6-5-11(20-4)7-13(12)18/h5-7,10,18H,8-9,16H2,1-4H3,(H,17,19).
What are the key properties of N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide?
N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide has a molecular weight of 280.37 g/mol, XLogP of 1.89, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,4-dimethylpentan-2-yl)-2-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 115309726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).