3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide

C19H22ClNO3 — CID 133220664

IUPAC3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide
SMILESCOc1ccccc1OCC(C)NC(=O)CCc1ccc(Cl)cc1
InChIInChI=1S/C19H22ClNO3/c1-14(13-24-18-6-4-3-5-17(18)23-2)21-19(22)12-9-15-7-10-16(20)11-8-15/h3-8,10-11,14H,9,12-13H2,1-2H3,(H,21,22)
InChIKeyPJFZOTDAURYUKI-UHFFFAOYSA-N
MW347.84 g/mol
LogP3.86
Rot. Bonds8

About 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide

3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide (PubChem CID 133220664) has the molecular formula C19H22ClNO3 and a molecular weight of 347.84 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide
PubChem CID133220664
Molecular FormulaC19H22ClNO3
Molecular Weight347.84 g/mol
Exact Mass347.13
IUPAC Name3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide
SMILESCOc1ccccc1OCC(C)NC(=O)CCc1ccc(Cl)cc1
InChIInChI=1S/C19H22ClNO3/c1-14(13-24-18-6-4-3-5-17(18)23-2)21-19(22)12-9-15-7-10-16(20)11-8-15/h3-8,10-11,14H,9,12-13H2,1-2H3,(H,21,22)
InChIKeyPJFZOTDAURYUKI-UHFFFAOYSA-N
XLogP3.86
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.84
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide (CID 133220664) is 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide is COc1ccccc1OCC(C)NC(=O)CCc1ccc(Cl)cc1.
What is the InChIKey of 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide?
The InChIKey is PJFZOTDAURYUKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO3/c1-14(13-24-18-6-4-3-5-17(18)23-2)21-19(22)12-9-15-7-10-16(20)11-8-15/h3-8,10-11,14H,9,12-13H2,1-2H3,(H,21,22).
What are the key properties of 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide?
3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide has a molecular weight of 347.84 g/mol, XLogP of 3.86, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-[1-(2-methoxyphenoxy)propan-2-yl]propanamide is sourced from PubChem (CID 133220664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).