2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide

C20H32N2O3 — CID 47036184

IUPAC2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide
SMILESCOc1cccc(COC(C)C(=O)NCC(C)N2CCCC(C)C2)c1
InChIInChI=1S/C20H32N2O3/c1-15-7-6-10-22(13-15)16(2)12-21-20(23)17(3)25-14-18-8-5-9-19(11-18)24-4/h5,8-9,11,15-17H,6-7,10,12-14H2,1-4H3,(H,21,23)
InChIKeyGTDUFCNQBCWTGZ-UHFFFAOYSA-N
MW348.49 g/mol
LogP2.84
Rot. Bonds8

About 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide

2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide (PubChem CID 47036184) has the molecular formula C20H32N2O3 and a molecular weight of 348.49 g/mol. Its IUPAC name is 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide.

Molecular Properties

Compound Name2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide
PubChem CID47036184
Molecular FormulaC20H32N2O3
Molecular Weight348.49 g/mol
Exact Mass348.24
IUPAC Name2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide
SMILESCOc1cccc(COC(C)C(=O)NCC(C)N2CCCC(C)C2)c1
InChIInChI=1S/C20H32N2O3/c1-15-7-6-10-22(13-15)16(2)12-21-20(23)17(3)25-14-18-8-5-9-19(11-18)24-4/h5,8-9,11,15-17H,6-7,10,12-14H2,1-4H3,(H,21,23)
InChIKeyGTDUFCNQBCWTGZ-UHFFFAOYSA-N
XLogP2.84
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.49
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(methoxymethyl)-N-[(2R)-2-[(3R)-3-methylpiperidin-1-yl]propyl]benzamide
CID 100850955
2-[(3-methoxyphenyl)methoxy]-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 119462030
2-[3-(hydroxymethyl)phenoxy]-N-[2-(4-methylpiperidin-1-yl)propyl]propanamide
CID 109388933
N-(3-aminobutyl)-2-[(3-methoxyphenyl)methoxy]propanamide;hydrochloride
CID 119497040
(2R)-1-[2-[(3-methoxyphenyl)methoxy]propanoyl]pyrrolidine-2-carboxylic acid
CID 119371716
(2R)-N-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[(3-methoxyphenyl)methoxy]propanamide
CID 95335268
1-cyclopropyl-1-[(3-methoxyphenyl)methyl]-3-[(2S)-2-pyrrolidin-1-ylpropyl]urea
CID 125437502
N-[(2-tert-butyloxolan-3-yl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide
CID 56791697
2-[(3-methoxyphenyl)methoxy]-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide
CID 60599675
3-amino-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide
CID 119850765
4-bromo-3,5-dimethoxy-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide
CID 55717834
3-amino-2-methyl-N-[2-(3-methylpiperidin-1-yl)propyl]-3-phenylpropanamide
CID 119850745

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide?
The IUPAC name of 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide (CID 47036184) is 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide.
What is the SMILES notation for 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide?
The canonical SMILES for 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide is COc1cccc(COC(C)C(=O)NCC(C)N2CCCC(C)C2)c1.
What is the InChIKey of 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide?
The InChIKey is GTDUFCNQBCWTGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O3/c1-15-7-6-10-22(13-15)16(2)12-21-20(23)17(3)25-14-18-8-5-9-19(11-18)24-4/h5,8-9,11,15-17H,6-7,10,12-14H2,1-4H3,(H,21,23).
What are the key properties of 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide?
2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide has a molecular weight of 348.49 g/mol, XLogP of 2.84, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyphenyl)methoxy]-N-[2-(3-methylpiperidin-1-yl)propyl]propanamide is sourced from PubChem (CID 47036184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).