2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide

C13H17NO2 — CID 115968436

IUPAC2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide
SMILESC=C(C)CN(C)C(=O)c1cc(C)ccc1O
InChIInChI=1S/C13H17NO2/c1-9(2)8-14(4)13(16)11-7-10(3)5-6-12(11)15/h5-7,15H,1,8H2,2-4H3
InChIKeyCHIKMJSMENXLJK-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.35
Rot. Bonds3

About 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide

2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide (PubChem CID 115968436) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide
PubChem CID115968436
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide
SMILESC=C(C)CN(C)C(=O)c1cc(C)ccc1O
InChIInChI=1S/C13H17NO2/c1-9(2)8-14(4)13(16)11-7-10(3)5-6-12(11)15/h5-7,15H,1,8H2,2-4H3
InChIKeyCHIKMJSMENXLJK-UHFFFAOYSA-N
XLogP2.35
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-bromo-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide
CID 115968411
N-(2-amino-2-hydroxyiminoethyl)-2-hydroxy-N,5-dimethylbenzamide
CID 76928817
2-hydroxy-N-(2-hydroxyethyl)-N,5-dimethylbenzamide
CID 60652527
2-hydroxy-N,5-dimethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzamide
CID 47140666
N-(2,2-difluoroethyl)-2-hydroxy-N,5-dimethylbenzamide
CID 115611587
2-[ethyl-(2-hydroxy-5-methylbenzoyl)amino]acetic acid
CID 54901352
2-chloro-5-hydroxy-N-methyl-N-(2-methylprop-2-enyl)benzamide
CID 106502176
N-[(4-bromophenyl)methyl]-2-hydroxy-N,5-dimethylbenzamide
CID 42987430
2-hydroxy-N-(1H-imidazol-2-ylmethyl)-N,5-dimethylbenzamide
CID 63929949
2-[(2-hydroxy-5-methylbenzoyl)-propylamino]acetic acid
CID 61011942
2-hydroxy-N-methyl-N-(2-methylprop-2-enyl)-4-nitrobenzamide
CID 86798485
2-[(2,5-dimethylbenzoyl)-methylamino]acetic acid
CID 18071913

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide?
The IUPAC name of 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide (CID 115968436) is 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide.
What is the SMILES notation for 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide?
The canonical SMILES for 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide is C=C(C)CN(C)C(=O)c1cc(C)ccc1O.
What is the InChIKey of 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide?
The InChIKey is CHIKMJSMENXLJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-9(2)8-14(4)13(16)11-7-10(3)5-6-12(11)15/h5-7,15H,1,8H2,2-4H3.
What are the key properties of 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide?
2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide has a molecular weight of 219.28 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N,5-dimethyl-N-(2-methylprop-2-enyl)benzamide is sourced from PubChem (CID 115968436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).