2-acetamido-N-(2,5-diethoxyphenyl)propanamide

C15H22N2O4 — CID 78778179

IUPAC2-acetamido-N-(2,5-diethoxyphenyl)propanamide
SMILESCCOc1ccc(OCC)c(NC(=O)C(C)NC(C)=O)c1
InChIInChI=1S/C15H22N2O4/c1-5-20-12-7-8-14(21-6-2)13(9-12)17-15(19)10(3)16-11(4)18/h7-10H,5-6H2,1-4H3,(H,16,18)(H,17,19)
InChIKeyVMMKFCQDUQGBEY-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.95
Rot. Bonds7

About 2-acetamido-N-(2,5-diethoxyphenyl)propanamide

2-acetamido-N-(2,5-diethoxyphenyl)propanamide (PubChem CID 78778179) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-acetamido-N-(2,5-diethoxyphenyl)propanamide.

Molecular Properties

Compound Name2-acetamido-N-(2,5-diethoxyphenyl)propanamide
PubChem CID78778179
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name2-acetamido-N-(2,5-diethoxyphenyl)propanamide
SMILESCCOc1ccc(OCC)c(NC(=O)C(C)NC(C)=O)c1
InChIInChI=1S/C15H22N2O4/c1-5-20-12-7-8-14(21-6-2)13(9-12)17-15(19)10(3)16-11(4)18/h7-10H,5-6H2,1-4H3,(H,16,18)(H,17,19)
InChIKeyVMMKFCQDUQGBEY-UHFFFAOYSA-N
XLogP1.95
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-diethoxyphenyl)-2-methoxypropanamide
CID 47301395
2-(4-chlorophenoxy)-N-(2,5-diethoxyphenyl)propanamide
CID 43000685
(2R)-2-amino-N-(2,5-diethoxyphenyl)pentanamide
CID 103794070
N-[3-[1-[(2,5-diethoxyphenyl)carbamoylamino]ethyl]phenyl]acetamide
CID 47032890
2-(2,5-diethoxyanilino)-N-ethylpropanamide
CID 43088911
N-(2,5-diethoxyphenyl)-2-(propan-2-ylamino)acetamide
CID 60703669
4-(2,5-diethoxyanilino)-4-oxobutanoic acid
CID 1133656
3,5-diacetamido-N-(2,5-diethoxyphenyl)benzamide
CID 9490111
2-acetamido-N-[2-propoxy-5-(trifluoromethyl)phenyl]propanamide
CID 78777880
(2S)-N-(2,5-diethoxyphenyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 9118488
1-butyl-3-(2,5-diethoxyphenyl)urea
CID 115569945
2-chloro-N-[(2,5-diethoxyphenyl)carbamoyl]acetamide
CID 43328839

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(2,5-diethoxyphenyl)propanamide?
The IUPAC name of 2-acetamido-N-(2,5-diethoxyphenyl)propanamide (CID 78778179) is 2-acetamido-N-(2,5-diethoxyphenyl)propanamide.
What is the SMILES notation for 2-acetamido-N-(2,5-diethoxyphenyl)propanamide?
The canonical SMILES for 2-acetamido-N-(2,5-diethoxyphenyl)propanamide is CCOc1ccc(OCC)c(NC(=O)C(C)NC(C)=O)c1.
What is the InChIKey of 2-acetamido-N-(2,5-diethoxyphenyl)propanamide?
The InChIKey is VMMKFCQDUQGBEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-5-20-12-7-8-14(21-6-2)13(9-12)17-15(19)10(3)16-11(4)18/h7-10H,5-6H2,1-4H3,(H,16,18)(H,17,19).
What are the key properties of 2-acetamido-N-(2,5-diethoxyphenyl)propanamide?
2-acetamido-N-(2,5-diethoxyphenyl)propanamide has a molecular weight of 294.35 g/mol, XLogP of 1.95, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(2,5-diethoxyphenyl)propanamide is sourced from PubChem (CID 78778179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).