2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide

C21H26N2O4 — CID 2899982

IUPAC2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide
SMILESCc1ccc(OCC(=O)NCC(C)NC(=O)COc2ccc(C)cc2)cc1
InChIInChI=1S/C21H26N2O4/c1-15-4-8-18(9-5-15)26-13-20(24)22-12-17(3)23-21(25)14-27-19-10-6-16(2)7-11-19/h4-11,17H,12-14H2,1-3H3,(H,22,24)(H,23,25)
InChIKeySOZNSFROCCBRNR-UHFFFAOYSA-N
MW370.45 g/mol
LogP2.38
Rot. Bonds9

About 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide

2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide (PubChem CID 2899982) has the molecular formula C21H26N2O4 and a molecular weight of 370.45 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide
PubChem CID2899982
Molecular FormulaC21H26N2O4
Molecular Weight370.45 g/mol
Exact Mass370.19
IUPAC Name2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide
SMILESCc1ccc(OCC(=O)NCC(C)NC(=O)COc2ccc(C)cc2)cc1
InChIInChI=1S/C21H26N2O4/c1-15-4-8-18(9-5-15)26-13-20(24)22-12-17(3)23-21(25)14-27-19-10-6-16(2)7-11-19/h4-11,17H,12-14H2,1-3H3,(H,22,24)(H,23,25)
InChIKeySOZNSFROCCBRNR-UHFFFAOYSA-N
XLogP2.38
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(4-methylphenoxy)phenoxy]-N-(2-methylpropyl)acetamide
CID 23732384
N-(2-hydroxypropyl)-2-[4-(4-methylphenoxy)phenoxy]acetamide
CID 78855960
2-naphthalen-2-yloxy-N-[2-[(2-naphthalen-2-yloxyacetyl)amino]propyl]acetamide
CID 3635526
2-(4-methylphenoxy)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
CID 103726206
3-[[[2-(4-methylphenoxy)acetyl]amino]methyl]pentanoic acid
CID 81065403
3-methoxy-4-[[2-(4-methylphenoxy)acetyl]amino]butanoic acid
CID 103152460
N-(1,3-dihydroxypropan-2-yl)-2-(4-methylphenoxy)acetamide
CID 65312489
2-(4-chlorophenoxy)-N-[1-(4-methylphenyl)propan-2-yl]acetamide
CID 123862391
N-[[(2S)-butan-2-yl]carbamoyl]-2-(4-methylphenoxy)acetamide
CID 7817259
N-[1-(4-methylphenoxy)propan-2-yl]-2-naphthalen-2-yloxyacetamide
CID 132652959
N'-[2-(4-methylphenoxy)acetyl]propanehydrazide
CID 4635692
2-(4-bromophenoxy)-N-[2-(methylamino)propyl]acetamide;hydrochloride
CID 120829879

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide?
The IUPAC name of 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide (CID 2899982) is 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide is Cc1ccc(OCC(=O)NCC(C)NC(=O)COc2ccc(C)cc2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide?
The InChIKey is SOZNSFROCCBRNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4/c1-15-4-8-18(9-5-15)26-13-20(24)22-12-17(3)23-21(25)14-27-19-10-6-16(2)7-11-19/h4-11,17H,12-14H2,1-3H3,(H,22,24)(H,23,25).
What are the key properties of 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide?
2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide has a molecular weight of 370.45 g/mol, XLogP of 2.38, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-[2-[[2-(4-methylphenoxy)acetyl]amino]propyl]acetamide is sourced from PubChem (CID 2899982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).