2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide

C20H25NO2 — CID 20650419

IUPAC2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide
SMILESCc1cc(C)c(Cc2cc(C)c(O)c(C(=O)N(C)C)c2)c(C)c1
InChIInChI=1S/C20H25NO2/c1-12-7-13(2)17(14(3)8-12)10-16-9-15(4)19(22)18(11-16)20(23)21(5)6/h7-9,11,22H,10H2,1-6H3
InChIKeyQHTXPLIQFYYWHX-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.92
Rot. Bonds3

About 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide

2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide (PubChem CID 20650419) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide
PubChem CID20650419
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide
SMILESCc1cc(C)c(Cc2cc(C)c(O)c(C(=O)N(C)C)c2)c(C)c1
InChIInChI=1S/C20H25NO2/c1-12-7-13(2)17(14(3)8-12)10-16-9-15(4)19(22)18(11-16)20(23)21(5)6/h7-9,11,22H,10H2,1-6H3
InChIKeyQHTXPLIQFYYWHX-UHFFFAOYSA-N
XLogP3.92
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol
CID 21282731
2-hydroxy-5-[[4-[[2,4,6-trimethyl-3-[[4-[(2,4,6-trimethylphenyl)methyl]phenyl]methyl]phenyl]methyl]phenyl]methyl]benzoic acid
CID 101328688
2-hydroxy-N,N,3,5-tetramethylbenzenecarbothioamide
CID 137192921
3-amino-2-hydroxy-N,N,4,5-tetramethylbenzamide
CID 130018685
2-[(3,5-difluorophenyl)methyl]-1,3,5-trimethylbenzene
CID 150549971
methyl 2-hydroxy-5-(3-hydroxypropyl)-3-methylbenzoate
CID 77231111
2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol
CID 22011679
(2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone
CID 13251027
3-tert-butyl-2-hydroxy-N,5-dimethyl-N-[2-(methylamino)ethyl]benzamide
CID 139769312
2,6-bis[(3-ethyl-4-hydroxy-5-methylphenyl)methyl]-4-methylphenol
CID 134464799
2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol
CID 21344476
carbanide;2-[[5-[[5-[[5-[[3-[(5-ethyl-2-hydroxy-3-methylphenyl)methyl]-4-hydroxy-5-methylphenyl]methyl]-2-hydroxy-3-methylphenyl]methyl]-2-hydroxy-3-methylphenyl]methyl]-2-hydroxy-3-methylphenyl]methyl]-4,6-dimethylphenol;bis(titanium(2+))
CID 59071786

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide?
The IUPAC name of 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide (CID 20650419) is 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide.
What is the SMILES notation for 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide?
The canonical SMILES for 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide is Cc1cc(C)c(Cc2cc(C)c(O)c(C(=O)N(C)C)c2)c(C)c1.
What is the InChIKey of 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide?
The InChIKey is QHTXPLIQFYYWHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-12-7-13(2)17(14(3)8-12)10-16-9-15(4)19(22)18(11-16)20(23)21(5)6/h7-9,11,22H,10H2,1-6H3.
What are the key properties of 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide?
2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide has a molecular weight of 311.43 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N,N,3-trimethyl-5-[(2,4,6-trimethylphenyl)methyl]benzamide is sourced from PubChem (CID 20650419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).