3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide

C19H18N2O2 — CID 5299704

IUPAC3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide
SMILESCOc1ccc(CCC(=O)Nc2cnc3ccccc3c2)cc1
InChIInChI=1S/C19H18N2O2/c1-23-17-9-6-14(7-10-17)8-11-19(22)21-16-12-15-4-2-3-5-18(15)20-13-16/h2-7,9-10,12-13H,8,11H2,1H3,(H,21,22)
InChIKeyHQSSLJNIPWCPDE-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.81
Rot. Bonds5

About 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide

3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide (PubChem CID 5299704) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide
PubChem CID5299704
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide
SMILESCOc1ccc(CCC(=O)Nc2cnc3ccccc3c2)cc1
InChIInChI=1S/C19H18N2O2/c1-23-17-9-6-14(7-10-17)8-11-19(22)21-16-12-15-4-2-3-5-18(15)20-13-16/h2-7,9-10,12-13H,8,11H2,1H3,(H,21,22)
InChIKeyHQSSLJNIPWCPDE-UHFFFAOYSA-N
XLogP3.81
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide (CID 5299704) is 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide is COc1ccc(CCC(=O)Nc2cnc3ccccc3c2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide?
The InChIKey is HQSSLJNIPWCPDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-23-17-9-6-14(7-10-17)8-11-19(22)21-16-12-15-4-2-3-5-18(15)20-13-16/h2-7,9-10,12-13H,8,11H2,1H3,(H,21,22).
What are the key properties of 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide?
3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide has a molecular weight of 306.37 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide is sourced from PubChem (CID 5299704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).