2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide

C14H21NO2 — CID 43372458

IUPAC2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide
SMILESCc1ccc(O)c(C(=O)NC(C)CC(C)C)c1
InChIInChI=1S/C14H21NO2/c1-9(2)7-11(4)15-14(17)12-8-10(3)5-6-13(12)16/h5-6,8-9,11,16H,7H2,1-4H3,(H,15,17)
InChIKeyFWKMADSJTQYUGF-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.87
Rot. Bonds4

About 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide

2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide (PubChem CID 43372458) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide.

Molecular Properties

Compound Name2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide
PubChem CID43372458
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide
SMILESCc1ccc(O)c(C(=O)NC(C)CC(C)C)c1
InChIInChI=1S/C14H21NO2/c1-9(2)7-11(4)15-14(17)12-8-10(3)5-6-13(12)16/h5-6,8-9,11,16H,7H2,1-4H3,(H,15,17)
InChIKeyFWKMADSJTQYUGF-UHFFFAOYSA-N
XLogP2.87
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-hydroxy-N-[(2R)-1-hydroxypropan-2-yl]-5-methylbenzamide
CID 79030607
2-hydroxy-5-methyl-N-(1-methylsulfanylpropan-2-yl)benzamide
CID 115636004
N-(4-bromobutan-2-yl)-2-hydroxy-5-methylbenzamide
CID 83180515
N-[4-(dimethylamino)butan-2-yl]-2-hydroxy-5-methylbenzamide
CID 54968038
2-hydroxy-5-methyl-N-(3-methylbutan-2-yl)benzamide
CID 43084907
2-hydroxy-5-methyl-N-(4-phenylbutan-2-yl)benzamide
CID 42909032
N-(2-chloro-4-methylpentyl)-2-hydroxy-5-methylbenzamide
CID 107157185
4-methyl-N-[(2S)-4-methylpentan-2-yl]benzamide
CID 836976
N-(1-chloro-4-methylpentan-3-yl)-2-hydroxy-5-methylbenzamide
CID 114177673
2-hydroxy-N-[(2R)-1-hydroxybutan-2-yl]-5-methylbenzamide
CID 103920351
N-(1-amino-3-methyl-1-oxobutan-2-yl)-2-hydroxy-5-methylbenzamide
CID 113233078
2-amino-N-(4-hydroxypentan-2-yl)-5-methylbenzamide
CID 113375955

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide?
The IUPAC name of 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide (CID 43372458) is 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide.
What is the SMILES notation for 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide?
The canonical SMILES for 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide is Cc1ccc(O)c(C(=O)NC(C)CC(C)C)c1.
What is the InChIKey of 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide?
The InChIKey is FWKMADSJTQYUGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-9(2)7-11(4)15-14(17)12-8-10(3)5-6-13(12)16/h5-6,8-9,11,16H,7H2,1-4H3,(H,15,17).
What are the key properties of 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide?
2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide has a molecular weight of 235.33 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-methyl-N-(4-methylpentan-2-yl)benzamide is sourced from PubChem (CID 43372458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).