2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide

C19H22ClNO5 — CID 132656973

IUPAC2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CNC(=O)C(C)Oc2ccccc2Cl)c(OC)c1OC
InChIInChI=1S/C19H22ClNO5/c1-12(26-15-8-6-5-7-14(15)20)19(22)21-11-13-9-10-16(23-2)18(25-4)17(13)24-3/h5-10,12H,11H2,1-4H3,(H,21,22)
InChIKeyXEFIETCSHXRKRB-UHFFFAOYSA-N
MW379.84 g/mol
LogP3.45
Rot. Bonds8

About 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide

2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide (PubChem CID 132656973) has the molecular formula C19H22ClNO5 and a molecular weight of 379.84 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
PubChem CID132656973
Molecular FormulaC19H22ClNO5
Molecular Weight379.84 g/mol
Exact Mass379.12
IUPAC Name2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CNC(=O)C(C)Oc2ccccc2Cl)c(OC)c1OC
InChIInChI=1S/C19H22ClNO5/c1-12(26-15-8-6-5-7-14(15)20)19(22)21-11-13-9-10-16(23-2)18(25-4)17(13)24-3/h5-10,12H,11H2,1-4H3,(H,21,22)
InChIKeyXEFIETCSHXRKRB-UHFFFAOYSA-N
XLogP3.45
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.84
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-propan-2-ylphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 43876908
2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 132660138
(2S)-2-(4-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 94049685
2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 43910190
N-[(2-chlorophenyl)methyl]-2-(2,3,4-trimethoxyphenyl)acetamide
CID 9079447
2-(2-chlorophenoxy)-N-[(3-hydroxy-4-methoxyphenyl)methyl]propanamide
CID 60528119
(2R)-N-[(2,4-dichlorophenyl)methyl]-2-(2-methoxyphenoxy)propanamide
CID 9172784
2-(2-chlorophenoxy)-N-[(2S)-2-hydroxypropyl]propanamide
CID 83030471
(2S)-2-(2-chlorophenoxy)-N-[(4-fluorophenyl)methyl]propanamide
CID 26529894
(2S)-2-(3,4-dichlorophenoxy)-N-[(2-methoxyphenyl)methyl]propanamide
CID 26539751
methyl 3-[2-(2-chlorophenoxy)propanoylamino]propanoate
CID 60739964
N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 18425632

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide (CID 132656973) is 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide is COc1ccc(CNC(=O)C(C)Oc2ccccc2Cl)c(OC)c1OC.
What is the InChIKey of 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
The InChIKey is XEFIETCSHXRKRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO5/c1-12(26-15-8-6-5-7-14(15)20)19(22)21-11-13-9-10-16(23-2)18(25-4)17(13)24-3/h5-10,12H,11H2,1-4H3,(H,21,22).
What are the key properties of 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide has a molecular weight of 379.84 g/mol, XLogP of 3.45, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide is sourced from PubChem (CID 132656973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).