3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide

C19H23NO2 — CID 87009451

IUPAC3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide
SMILESCOc1ccc(CCC(=O)N(c2ccccc2)C(C)C)cc1
InChIInChI=1S/C19H23NO2/c1-15(2)20(17-7-5-4-6-8-17)19(21)14-11-16-9-12-18(22-3)13-10-16/h4-10,12-13,15H,11,14H2,1-3H3
InChIKeyADDZVAJNYNMYCJ-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.07
Rot. Bonds6

About 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide

3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide (PubChem CID 87009451) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide
PubChem CID87009451
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide
SMILESCOc1ccc(CCC(=O)N(c2ccccc2)C(C)C)cc1
InChIInChI=1S/C19H23NO2/c1-15(2)20(17-7-5-4-6-8-17)19(21)14-11-16-9-12-18(22-3)13-10-16/h4-10,12-13,15H,11,14H2,1-3H3
InChIKeyADDZVAJNYNMYCJ-UHFFFAOYSA-N
XLogP4.07
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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N-[2-(4-methoxyphenyl)ethyl]-2-[(4-methoxyphenyl)methyl-(3-phenylpropanoyl)amino]propanamide
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2-(4-methoxy-N-[2-(trifluoromethyl)phenyl]sulfonylanilino)-N-phenyl-N-propan-2-ylacetamide
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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide (CID 87009451) is 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide is COc1ccc(CCC(=O)N(c2ccccc2)C(C)C)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide?
The InChIKey is ADDZVAJNYNMYCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-15(2)20(17-7-5-4-6-8-17)19(21)14-11-16-9-12-18(22-3)13-10-16/h4-10,12-13,15H,11,14H2,1-3H3.
What are the key properties of 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide?
3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide has a molecular weight of 297.40 g/mol, XLogP of 4.07, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-phenyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 87009451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).