N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide

C16H18N2O2 — CID 43405605

IUPACN-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(N(C)C)cc2)c1O
InChIInChI=1S/C16H18N2O2/c1-11-5-4-6-14(15(11)19)16(20)17-12-7-9-13(10-8-12)18(2)3/h4-10,19H,1-3H3,(H,17,20)
InChIKeyZOUCSLQTANVMKX-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.02
Rot. Bonds3

About N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide

N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide (PubChem CID 43405605) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide
PubChem CID43405605
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(N(C)C)cc2)c1O
InChIInChI=1S/C16H18N2O2/c1-11-5-4-6-14(15(11)19)16(20)17-12-7-9-13(10-8-12)18(2)3/h4-10,19H,1-3H3,(H,17,20)
InChIKeyZOUCSLQTANVMKX-UHFFFAOYSA-N
XLogP3.02
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

methyl 4-[(2-hydroxy-3-methylbenzoyl)amino]benzoate
CID 43422488
2-hydroxy-N-[4-(2-hydroxyethyl)phenyl]-3-methylbenzamide
CID 61223601
2-hydroxy-3-methyl-N-(4-methylsulfonylphenyl)benzamide
CID 29268979
2-[[4-(dimethylamino)phenyl]carbamoyl]benzoic acid
CID 4544849
N-[3-[ethyl(methyl)amino]phenyl]-2-hydroxy-3-methylbenzamide
CID 86880325
N-[4-(cyanomethyl)phenyl]-2-hydroxy-3-methylbenzamide
CID 60682495
3-bromo-N-[4-(dimethylamino)phenyl]-2-fluorobenzamide
CID 106543999
N-[4-(diethylamino)phenyl]-2-iodo-3-methylbenzamide
CID 55685027
N-[4-(dimethylamino)phenyl]-2-ethylsulfanylbenzamide
CID 4631711
2-fluoro-4-[(2-hydroxy-3-methylbenzoyl)amino]benzoic acid
CID 103867338
2-bromo-5-[(2-hydroxy-3-methylbenzoyl)amino]benzoic acid
CID 115295582
N-[4-(dimethylamino)phenyl]-3-fluoro-2-hydrazinylbenzamide
CID 62660783

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide?
The IUPAC name of N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide (CID 43405605) is N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide.
What is the SMILES notation for N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide?
The canonical SMILES for N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide is Cc1cccc(C(=O)Nc2ccc(N(C)C)cc2)c1O.
What is the InChIKey of N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide?
The InChIKey is ZOUCSLQTANVMKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-5-4-6-14(15(11)19)16(20)17-12-7-9-13(10-8-12)18(2)3/h4-10,19H,1-3H3,(H,17,20).
What are the key properties of N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide?
N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide has a molecular weight of 270.33 g/mol, XLogP of 3.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)phenyl]-2-hydroxy-3-methylbenzamide is sourced from PubChem (CID 43405605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).