2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide

C21H26N2O3 — CID 131930532

IUPAC2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide
SMILESCOc1ccccc1OC(C)C(=O)Nc1cccc(CN2CCCC2)c1
InChIInChI=1S/C21H26N2O3/c1-16(26-20-11-4-3-10-19(20)25-2)21(24)22-18-9-7-8-17(14-18)15-23-12-5-6-13-23/h3-4,7-11,14,16H,5-6,12-13,15H2,1-2H3,(H,22,24)
InChIKeyLPHNCCCLXOYTHT-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.70
Rot. Bonds7

About 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide

2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide (PubChem CID 131930532) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide
PubChem CID131930532
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC Name2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide
SMILESCOc1ccccc1OC(C)C(=O)Nc1cccc(CN2CCCC2)c1
InChIInChI=1S/C21H26N2O3/c1-16(26-20-11-4-3-10-19(20)25-2)21(24)22-18-9-7-8-17(14-18)15-23-12-5-6-13-23/h3-4,7-11,14,16H,5-6,12-13,15H2,1-2H3,(H,22,24)
InChIKeyLPHNCCCLXOYTHT-UHFFFAOYSA-N
XLogP3.70
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-bromophenyl)-2-(2-methoxyphenoxy)propanamide
CID 17252166
(2S,3S)-2-amino-3-methyl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pentanamide
CID 61178548
1-[[3-[2-(4-phenylphenoxy)propanoylamino]phenyl]methyl]piperidine-4-carboxamide
CID 60520535
2-(2-methoxyphenoxy)-N-[3-(2-methylpropoxy)phenyl]propanamide
CID 17079595
(2R)-2-(2-methoxyphenoxy)-N-(4-piperidin-1-ylphenyl)propanamide
CID 7550758
2-benzylsulfanyl-N-[3-(piperidin-1-ylmethyl)phenyl]propanamide
CID 55778351
2-(2-chlorophenoxy)-N-[[3-(piperidin-1-ylmethyl)phenyl]methyl]propanamide
CID 133189350
(2S)-2-amino-3-(4-methoxyphenyl)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide
CID 131950206
2-(2-methoxyphenoxy)-N-[4-[[4-[2-(2-methoxyphenoxy)propanoylamino]phenyl]methyl]phenyl]propanamide
CID 4943540
(2R)-2-(2-methoxyphenoxy)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 40745730
N-(4-acetamidophenyl)-2-(2-methoxyphenoxy)propanamide
CID 2907980
7-methoxy-N-[3-(piperidin-1-ylmethyl)phenyl]-1-benzofuran-2-carboxamide
CID 78867827

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide (CID 131930532) is 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide is COc1ccccc1OC(C)C(=O)Nc1cccc(CN2CCCC2)c1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide?
The InChIKey is LPHNCCCLXOYTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-16(26-20-11-4-3-10-19(20)25-2)21(24)22-18-9-7-8-17(14-18)15-23-12-5-6-13-23/h3-4,7-11,14,16H,5-6,12-13,15H2,1-2H3,(H,22,24).
What are the key properties of 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide?
2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide has a molecular weight of 354.45 g/mol, XLogP of 3.70, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide is sourced from PubChem (CID 131930532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).