2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide

C19H23NO3 — CID 17096796

IUPAC2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide
SMILESCCCOc1cccc(NC(=O)c2ccccc2OC(C)C)c1
InChIInChI=1S/C19H23NO3/c1-4-12-22-16-9-7-8-15(13-16)20-19(21)17-10-5-6-11-18(17)23-14(2)3/h5-11,13-14H,4,12H2,1-3H3,(H,20,21)
InChIKeyWTZRZDLXDJCZLY-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.51
Rot. Bonds7

About 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide

2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide (PubChem CID 17096796) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide.

Molecular Properties

Compound Name2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide
PubChem CID17096796
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide
SMILESCCCOc1cccc(NC(=O)c2ccccc2OC(C)C)c1
InChIInChI=1S/C19H23NO3/c1-4-12-22-16-9-7-8-15(13-16)20-19(21)17-10-5-6-11-18(17)23-14(2)3/h5-11,13-14H,4,12H2,1-3H3,(H,20,21)
InChIKeyWTZRZDLXDJCZLY-UHFFFAOYSA-N
XLogP4.51
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 ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylpropoxy)-N-(3-propoxyphenyl)benzamide
CID 17096753
N-(4-butoxyphenyl)-2-propan-2-yloxybenzamide
CID 17045605
4-propan-2-yloxy-N-(3-propoxyphenyl)benzamide
CID 17096762
N-(3-prop-2-enoxyphenyl)-2-propoxybenzamide
CID 17086740
N-(3-hexoxyphenyl)-2-(3-methylbutoxy)benzamide
CID 17094817
2,4-dimethoxy-N-(3-propoxyphenyl)benzamide
CID 34372962
2-(2-phenylethoxy)-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154818
N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 17169883
2-hexoxy-N-[3-(2-methylpropoxy)phenyl]benzamide
CID 17079617
2-methoxy-N-[(3-propoxyphenyl)carbamothioyl]benzamide
CID 17097026
N-(3-acetylphenyl)-2-propoxybenzamide
CID 4947871
N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-2-propan-2-yloxybenzamide
CID 17079945

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide?
The IUPAC name of 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide (CID 17096796) is 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide.
What is the SMILES notation for 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide?
The canonical SMILES for 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide is CCCOc1cccc(NC(=O)c2ccccc2OC(C)C)c1.
What is the InChIKey of 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide?
The InChIKey is WTZRZDLXDJCZLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-4-12-22-16-9-7-8-15(13-16)20-19(21)17-10-5-6-11-18(17)23-14(2)3/h5-11,13-14H,4,12H2,1-3H3,(H,20,21).
What are the key properties of 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide?
2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide has a molecular weight of 313.40 g/mol, XLogP of 4.51, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide is sourced from PubChem (CID 17096796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).