N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide

C19H23NO3 — CID 4943415

IUPACN-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide
SMILESCOc1ccc(NC(=O)c2ccccc2OCCC(C)C)cc1
InChIInChI=1S/C19H23NO3/c1-14(2)12-13-23-18-7-5-4-6-17(18)19(21)20-15-8-10-16(22-3)11-9-15/h4-11,14H,12-13H2,1-3H3,(H,20,21)
InChIKeyYBMKBLCOGSDHLH-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.37
Rot. Bonds7

About N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide

N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide (PubChem CID 4943415) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide
PubChem CID4943415
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide
SMILESCOc1ccc(NC(=O)c2ccccc2OCCC(C)C)cc1
InChIInChI=1S/C19H23NO3/c1-14(2)12-13-23-18-7-5-4-6-17(18)19(21)20-15-8-10-16(22-3)11-9-15/h4-11,14H,12-13H2,1-3H3,(H,20,21)
InChIKeyYBMKBLCOGSDHLH-UHFFFAOYSA-N
XLogP4.37
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[4-[[2-(3-methylbutoxy)benzoyl]amino]phenyl]benzamide
CID 17251615
N-(4-benzamidophenyl)-2-(3-methylbutoxy)benzamide
CID 17235412
N-(3,4-dimethoxyphenyl)-2-(3-methylbutoxy)benzamide
CID 54781407
2-(3-methylbutoxy)-N-[4-(propanoylamino)phenyl]benzamide
CID 17204895
2-(3-methylbutoxy)-N-[4-(2-phenylethoxy)phenyl]benzamide
CID 17067004
2-ethoxy-N-(4-methoxyphenyl)benzamide
CID 5019237
2-methyl-N-[4-[[[2-(3-methylbutoxy)benzoyl]amino]carbamoyl]phenyl]benzamide
CID 4944008
N-[(4-hydroxyphenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide
CID 4944357
N-(4-anilinophenyl)-2-[[2-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide
CID 4944648
N-[(4-chlorophenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide
CID 4944368
2-[2-(dimethylamino)-2-oxoethoxy]-N-(4-methoxyphenyl)benzamide
CID 34815754
N-[(4-heptoxyphenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide
CID 4951664

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide (CID 4943415) is N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide is COc1ccc(NC(=O)c2ccccc2OCCC(C)C)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide?
The InChIKey is YBMKBLCOGSDHLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-14(2)12-13-23-18-7-5-4-6-17(18)19(21)20-15-8-10-16(22-3)11-9-15/h4-11,14H,12-13H2,1-3H3,(H,20,21).
What are the key properties of N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide?
N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide has a molecular weight of 313.40 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(3-methylbutoxy)benzamide is sourced from PubChem (CID 4943415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).