N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide

C13H18N2O3 — CID 60625657

IUPACN-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide
SMILESCCNC(=O)NC(=O)C(C)Oc1ccccc1C
InChIInChI=1S/C13H18N2O3/c1-4-14-13(17)15-12(16)10(3)18-11-8-6-5-7-9(11)2/h5-8,10H,4H2,1-3H3,(H2,14,15,16,17)
InChIKeyJMOOUVRDAIIEFI-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.61
Rot. Bonds4

About N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide

N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide (PubChem CID 60625657) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide
PubChem CID60625657
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC NameN-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide
SMILESCCNC(=O)NC(=O)C(C)Oc1ccccc1C
InChIInChI=1S/C13H18N2O3/c1-4-14-13(17)15-12(16)10(3)18-11-8-6-5-7-9(11)2/h5-8,10H,4H2,1-3H3,(H2,14,15,16,17)
InChIKeyJMOOUVRDAIIEFI-UHFFFAOYSA-N
XLogP1.61
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-amino-3-methylphenoxy)-N-(ethylcarbamoyl)propanamide
CID 43438016
(2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide
CID 2631962
N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide
CID 60625654
2-(5-amino-2-methylphenoxy)-N-(ethylcarbamoyl)propanamide
CID 43520156
2-[5-(aminomethyl)-2-methylphenoxy]-N-(ethylcarbamoyl)propanamide
CID 107655961
2-[2-(aminomethyl)-3-chlorophenoxy]-N-(ethylcarbamoyl)propanamide
CID 114318401
N-(ethylcarbamoyl)-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide
CID 63650613
N-ethyl-2-(2-hydroxyphenoxy)propanamide
CID 43143422
N-(ethylcarbamoyl)-2-(4-propan-2-ylphenoxy)propanamide
CID 60623989
[(2R)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] (2R)-2-phenoxypropanoate
CID 8791134
(2R)-N-(2-ethoxyphenyl)-2-(2-methylphenoxy)propanamide
CID 837498
(2S)-2-(2-methylphenoxy)-N-[(1R)-1-phenylpropyl]propanamide
CID 93234565

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide?
The IUPAC name of N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide (CID 60625657) is N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide is CCNC(=O)NC(=O)C(C)Oc1ccccc1C.
What is the InChIKey of N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide?
The InChIKey is JMOOUVRDAIIEFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-4-14-13(17)15-12(16)10(3)18-11-8-6-5-7-9(11)2/h5-8,10H,4H2,1-3H3,(H2,14,15,16,17).
What are the key properties of N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide?
N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide has a molecular weight of 250.30 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide is sourced from PubChem (CID 60625657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).