N-(2-propan-2-ylphenyl)-4-propoxybenzamide

C19H23NO2 — CID 6463952

IUPACN-(2-propan-2-ylphenyl)-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)Nc2ccccc2C(C)C)cc1
InChIInChI=1S/C19H23NO2/c1-4-13-22-16-11-9-15(10-12-16)19(21)20-18-8-6-5-7-17(18)14(2)3/h5-12,14H,4,13H2,1-3H3,(H,20,21)
InChIKeyVYXWTSHQDWHLBC-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.85
Rot. Bonds6

About N-(2-propan-2-ylphenyl)-4-propoxybenzamide

N-(2-propan-2-ylphenyl)-4-propoxybenzamide (PubChem CID 6463952) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(2-propan-2-ylphenyl)-4-propoxybenzamide.

Molecular Properties

Compound NameN-(2-propan-2-ylphenyl)-4-propoxybenzamide
PubChem CID6463952
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-(2-propan-2-ylphenyl)-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)Nc2ccccc2C(C)C)cc1
InChIInChI=1S/C19H23NO2/c1-4-13-22-16-11-9-15(10-12-16)19(21)20-18-8-6-5-7-17(18)14(2)3/h5-12,14H,4,13H2,1-3H3,(H,20,21)
InChIKeyVYXWTSHQDWHLBC-UHFFFAOYSA-N
XLogP4.85
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-methylbutoxy)-N-(2-propan-2-ylphenyl)benzamide
CID 17093762
4-pentoxy-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide
CID 17094051
4-propoxy-N-[5-[(4-propoxybenzoyl)amino]naphthalen-1-yl]benzamide
CID 4939588
4-N-(2-propan-2-ylphenyl)-1-N-propylbenzene-1,4-dicarboxamide
CID 109042975
4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109043167
[2-oxo-2-(2-propan-2-ylanilino)ethyl] 4-butoxybenzoate
CID 8863539
N-(2-propan-2-ylphenyl)benzamide
CID 723391
1-N-(4-methoxyphenyl)-4-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109049815
3,4,5-triethoxy-N-(2-propan-2-ylphenyl)benzamide
CID 1350696
1-N-butyl-4-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109043746
N-(1-phenylethyl)-2-[(4-propoxybenzoyl)amino]benzamide
CID 4938490
N-[2-[(2S)-butan-2-yl]phenyl]-4-(2-methylpropoxy)benzamide
CID 959904

Frequently Asked Questions

What is the IUPAC name of N-(2-propan-2-ylphenyl)-4-propoxybenzamide?
The IUPAC name of N-(2-propan-2-ylphenyl)-4-propoxybenzamide (CID 6463952) is N-(2-propan-2-ylphenyl)-4-propoxybenzamide.
What is the SMILES notation for N-(2-propan-2-ylphenyl)-4-propoxybenzamide?
The canonical SMILES for N-(2-propan-2-ylphenyl)-4-propoxybenzamide is CCCOc1ccc(C(=O)Nc2ccccc2C(C)C)cc1.
What is the InChIKey of N-(2-propan-2-ylphenyl)-4-propoxybenzamide?
The InChIKey is VYXWTSHQDWHLBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-4-13-22-16-11-9-15(10-12-16)19(21)20-18-8-6-5-7-17(18)14(2)3/h5-12,14H,4,13H2,1-3H3,(H,20,21).
What are the key properties of N-(2-propan-2-ylphenyl)-4-propoxybenzamide?
N-(2-propan-2-ylphenyl)-4-propoxybenzamide has a molecular weight of 297.40 g/mol, XLogP of 4.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propan-2-ylphenyl)-4-propoxybenzamide is sourced from PubChem (CID 6463952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).