N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide

C12H16N2O3 — CID 60625654

IUPACN-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide
SMILESCNC(=O)NC(=O)C(C)Oc1ccccc1C
InChIInChI=1S/C12H16N2O3/c1-8-6-4-5-7-10(8)17-9(2)11(15)14-12(16)13-3/h4-7,9H,1-3H3,(H2,13,14,15,16)
InChIKeyWKJUMHVXDCYCRX-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.22
Rot. Bonds3

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

N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide (PubChem CID 60625654) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide
PubChem CID60625654
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC NameN-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide
SMILESCNC(=O)NC(=O)C(C)Oc1ccccc1C
InChIInChI=1S/C12H16N2O3/c1-8-6-4-5-7-10(8)17-9(2)11(15)14-12(16)13-3/h4-7,9H,1-3H3,(H2,13,14,15,16)
InChIKeyWKJUMHVXDCYCRX-UHFFFAOYSA-N
XLogP1.22
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide
CID 60625657
(2R)-2-(2-chlorophenoxy)-N-(methylcarbamoyl)propanamide
CID 7815932
2-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 43084667
(2R)-N-(methylcarbamoyl)-2-(2-phenylphenoxy)propanamide
CID 7986963
2-[2-(aminomethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 43115833
(2R)-2-(4-chloro-2-methylphenoxy)-N-(methylcarbamoyl)propanamide
CID 8709004
2-[2-(2-hydroxyethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 107713094
1-methyl-3-[[(2S)-2-(2-methylphenoxy)propanoyl]amino]thiourea
CID 40648931
[(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] 3-(2-methylphenoxy)propanoate
CID 9140008
2-[2-(1-aminopropyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 43116458
2-(5-carbamothioyl-2-methylphenoxy)-N-(methylcarbamoyl)propanamide
CID 107656615
2-fluoro-6-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 107013997

Frequently Asked Questions

What is the IUPAC name of N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide?
The IUPAC name of N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide (CID 60625654) is N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide.
What is the SMILES notation for N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide?
The canonical SMILES for N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide is CNC(=O)NC(=O)C(C)Oc1ccccc1C.
What is the InChIKey of N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide?
The InChIKey is WKJUMHVXDCYCRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-8-6-4-5-7-10(8)17-9(2)11(15)14-12(16)13-3/h4-7,9H,1-3H3,(H2,13,14,15,16).
What are the key properties of N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide?
N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide has a molecular weight of 236.27 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methylcarbamoyl)-2-(2-methylphenoxy)propanamide is sourced from PubChem (CID 60625654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).