4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide

C19H22N2O3 — CID 26157492

IUPAC4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide
SMILESCc1cccc(OCC(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1
InChIInChI=1S/C19H22N2O3/c1-13(2)20-19(23)15-7-9-16(10-8-15)21-18(22)12-24-17-6-4-5-14(3)11-17/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyJPKCECFYFKBJKJ-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.15
Rot. Bonds6

About 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide

4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide (PubChem CID 26157492) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide
PubChem CID26157492
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide
SMILESCc1cccc(OCC(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1
InChIInChI=1S/C19H22N2O3/c1-13(2)20-19(23)15-7-9-16(10-8-15)21-18(22)12-24-17-6-4-5-14(3)11-17/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyJPKCECFYFKBJKJ-UHFFFAOYSA-N
XLogP3.15
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 2787094
N-propan-2-yl-4-[[2-(4-propan-2-ylphenoxy)acetyl]amino]benzamide
CID 26157459
2-(3-methylphenoxy)-N-(4-methylsulfanylphenyl)acetamide
CID 9153755
N-[3-[[2-(3-methylphenoxy)acetyl]amino]phenyl]propanamide
CID 883065
4-[[2-(3-methylphenoxy)acetyl]amino]-N,N-dipropylbenzamide
CID 17196123
2-(3-methylphenoxy)-N-[4-(N-propan-2-ylanilino)phenyl]acetamide
CID 4231625
N-[4-(difluoromethylsulfanyl)phenyl]-2-(3-methylphenoxy)acetamide
CID 26499511
2-(3-methylphenoxy)-N-(4-sulfamoylphenyl)acetamide
CID 675979
[2-oxo-2-(4-propan-2-ylanilino)ethyl] 2-(3-methylphenoxy)acetate
CID 8910812
4-[[2-(3-ethylphenoxy)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 43912204
N-[4-[2-(3-methylphenoxy)acetyl]phenyl]acetamide
CID 167959701
2-(3-methylphenoxy)-N-[4-(2H-tetrazol-5-yl)phenyl]acetamide
CID 110720239

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide?
The IUPAC name of 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide (CID 26157492) is 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide.
What is the SMILES notation for 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide?
The canonical SMILES for 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide is Cc1cccc(OCC(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1.
What is the InChIKey of 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide?
The InChIKey is JPKCECFYFKBJKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-13(2)20-19(23)15-7-9-16(10-8-15)21-18(22)12-24-17-6-4-5-14(3)11-17/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22).
What are the key properties of 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide?
4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide has a molecular weight of 326.40 g/mol, XLogP of 3.15, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(3-methylphenoxy)acetyl]amino]-N-propan-2-ylbenzamide is sourced from PubChem (CID 26157492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).