2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide

C19H29N3O3 — CID 77098358

IUPAC2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide
SMILESNC(=O)COc1ccc(CN2CCCCC2CN2CCOCC2)cc1
InChIInChI=1S/C19H29N3O3/c20-19(23)15-25-18-6-4-16(5-7-18)13-22-8-2-1-3-17(22)14-21-9-11-24-12-10-21/h4-7,17H,1-3,8-15H2,(H2,20,23)
InChIKeyBFJOOADXDIXPII-UHFFFAOYSA-N
MW347.46 g/mol
LogP1.24
Rot. Bonds7

About 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide

2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide (PubChem CID 77098358) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide
PubChem CID77098358
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Name2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide
SMILESNC(=O)COc1ccc(CN2CCCCC2CN2CCOCC2)cc1
InChIInChI=1S/C19H29N3O3/c20-19(23)15-25-18-6-4-16(5-7-18)13-22-8-2-1-3-17(22)14-21-9-11-24-12-10-21/h4-7,17H,1-3,8-15H2,(H2,20,23)
InChIKeyBFJOOADXDIXPII-UHFFFAOYSA-N
XLogP1.24
TPSA68.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[(2S)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-2-yl]methyl]morpholine
CID 97158896
2-[3-[[(2S)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide
CID 95310383
2-[3-[[2-(2-methoxyethyl)piperidin-1-yl]methyl]phenoxy]acetamide
CID 77080552
1-(4-methylphenoxy)-3-[2-(morpholin-4-ylmethyl)piperidin-1-yl]propan-2-ol
CID 111114259
2-[4-(morpholin-4-ylmethyl)phenoxy]acetic acid;hydrochloride
CID 46736007
2-[4-[[(2S)-2-(methoxymethyl)piperidin-1-yl]methyl]phenoxy]-1-piperidin-1-ylethanone
CID 99947078
4-[[1-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]piperidin-2-yl]methyl]morpholine
CID 46967160
2-[4-[[3-(aminomethyl)pyrrolidin-1-yl]methyl]phenoxy]acetamide
CID 62069126
4-[[(2S)-1-[(2,3,4-trifluorophenyl)methyl]piperidin-2-yl]methyl]morpholine
CID 99930489
2-[4-[[4-(methylaminomethyl)piperidin-1-yl]methyl]phenoxy]acetamide
CID 63251014
[4-(morpholin-4-ylmethyl)phenyl] carbamate
CID 175493722
N-[3-[4-(morpholin-4-ylmethyl)phenoxy]propyl]cyclohexanecarboxamide
CID 29214226

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide?
The IUPAC name of 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide (CID 77098358) is 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide.
What is the SMILES notation for 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide?
The canonical SMILES for 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide is NC(=O)COc1ccc(CN2CCCCC2CN2CCOCC2)cc1.
What is the InChIKey of 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide?
The InChIKey is BFJOOADXDIXPII-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c20-19(23)15-25-18-6-4-16(5-7-18)13-22-8-2-1-3-17(22)14-21-9-11-24-12-10-21/h4-7,17H,1-3,8-15H2,(H2,20,23).
What are the key properties of 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide?
2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide has a molecular weight of 347.46 g/mol, XLogP of 1.24, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[2-(morpholin-4-ylmethyl)piperidin-1-yl]methyl]phenoxy]acetamide is sourced from PubChem (CID 77098358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).