N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide

C19H23NO2 — CID 121296745

IUPACN-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide
SMILESCC(C)c1cccc(C(C)C)c1NC(=O)c1ccccc1O
InChIInChI=1S/C19H23NO2/c1-12(2)14-9-7-10-15(13(3)4)18(14)20-19(22)16-8-5-6-11-17(16)21/h5-13,21H,1-4H3,(H,20,22)
InChIKeyBHSVUQOOIJAPKQ-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.89
Rot. Bonds4

About N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide

N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide (PubChem CID 121296745) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide
PubChem CID121296745
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide
SMILESCC(C)c1cccc(C(C)C)c1NC(=O)c1ccccc1O
InChIInChI=1S/C19H23NO2/c1-12(2)14-9-7-10-15(13(3)4)18(14)20-19(22)16-8-5-6-11-17(16)21/h5-13,21H,1-4H3,(H,20,22)
InChIKeyBHSVUQOOIJAPKQ-UHFFFAOYSA-N
XLogP4.89
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2,6-di(propan-2-yl)phenyl]benzamide
CID 709320
2-(difluoromethoxy)-N-[2,6-di(propan-2-yl)phenyl]benzamide
CID 8778786
N-[2,6-di(propan-2-yl)phenyl]benzamide;hydroiodide
CID 175991462
N-[2,6-di(propan-2-yl)phenyl]-3,4-dihydroxybenzamide
CID 113199333
1,3-bis[2,6-di(propan-2-yl)phenyl]urea
CID 12058189
2-hydroxy-N-[2-(1-hydroxyethyl)phenyl]benzamide
CID 43508470
N-[2-(1-bromoethyl)phenyl]-2-hydroxybenzamide
CID 114315539
2,5-dihydroxy-N-(2-propan-2-ylphenyl)benzamide
CID 103891803
N-[2,6-di(propan-2-yl)phenyl]-2,3-dimethyl-1-benzofuran-7-carboxamide
CID 70200430
2-ethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 4106952
4-bromo-N-[2,6-di(propan-2-yl)phenyl]-2-fluorobenzamide
CID 26688276
2-hydroxy-N-(2-methyl-5-propan-2-ylphenyl)benzamide
CID 172640282

Frequently Asked Questions

What is the IUPAC name of N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide?
The IUPAC name of N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide (CID 121296745) is N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide.
What is the SMILES notation for N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide?
The canonical SMILES for N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide is CC(C)c1cccc(C(C)C)c1NC(=O)c1ccccc1O.
What is the InChIKey of N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide?
The InChIKey is BHSVUQOOIJAPKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-12(2)14-9-7-10-15(13(3)4)18(14)20-19(22)16-8-5-6-11-17(16)21/h5-13,21H,1-4H3,(H,20,22).
What are the key properties of N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide?
N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide has a molecular weight of 297.40 g/mol, XLogP of 4.89, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,6-di(propan-2-yl)phenyl]-2-hydroxybenzamide is sourced from PubChem (CID 121296745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).