2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide

C14H17N3O4 — CID 103566927

IUPAC2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)Oc1cc(C#N)cc(OC)c1
InChIInChI=1S/C14H17N3O4/c1-4-16-14(19)17-13(18)9(2)21-12-6-10(8-15)5-11(7-12)20-3/h5-7,9H,4H2,1-3H3,(H2,16,17,18,19)
InChIKeyMYMOLEVRDHEOQT-UHFFFAOYSA-N
MW291.31 g/mol
LogP1.18
Rot. Bonds5

About 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide

2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide (PubChem CID 103566927) has the molecular formula C14H17N3O4 and a molecular weight of 291.31 g/mol. Its IUPAC name is 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide
PubChem CID103566927
Molecular FormulaC14H17N3O4
Molecular Weight291.31 g/mol
Exact Mass291.12
IUPAC Name2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)Oc1cc(C#N)cc(OC)c1
InChIInChI=1S/C14H17N3O4/c1-4-16-14(19)17-13(18)9(2)21-12-6-10(8-15)5-11(7-12)20-3/h5-7,9H,4H2,1-3H3,(H2,16,17,18,19)
InChIKeyMYMOLEVRDHEOQT-UHFFFAOYSA-N
XLogP1.18
TPSA100.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[3-(aminomethyl)-5-methoxyphenoxy]-N-(ethylcarbamoyl)propanamide
CID 103565959
2-(3-cyano-5-methoxyphenoxy)-N-cyclopropylpropanamide
CID 103567041
2-(4-cyano-2-fluorophenoxy)-N-(ethylcarbamoyl)propanamide
CID 107670449
methyl 4-[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]oxybenzoate
CID 2103321
[1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 4-cyanobenzoate
CID 3976033
N-(ethylcarbamoyl)-2-(4-propan-2-ylphenoxy)propanamide
CID 60623989
N-(ethylcarbamoyl)-2-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide
CID 63364090
N-(ethylcarbamoyl)-2-[4-(hydroxymethyl)phenoxy]propanamide
CID 43082829
2-[3-(aminomethyl)phenoxy]-N-(ethylcarbamoyl)propanamide
CID 43115860
N-(ethylcarbamoyl)-2-[4-(2-oxopropyl)phenoxy]propanamide
CID 115495454
N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide
CID 60625657
N-(ethylcarbamoyl)-2-(1-methylpyrazol-4-yl)oxypropanamide
CID 116794030

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide?
The IUPAC name of 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide (CID 103566927) is 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide.
What is the SMILES notation for 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide?
The canonical SMILES for 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide is CCNC(=O)NC(=O)C(C)Oc1cc(C#N)cc(OC)c1.
What is the InChIKey of 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide?
The InChIKey is MYMOLEVRDHEOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O4/c1-4-16-14(19)17-13(18)9(2)21-12-6-10(8-15)5-11(7-12)20-3/h5-7,9H,4H2,1-3H3,(H2,16,17,18,19).
What are the key properties of 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide?
2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide has a molecular weight of 291.31 g/mol, XLogP of 1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyano-5-methoxyphenoxy)-N-(ethylcarbamoyl)propanamide is sourced from PubChem (CID 103566927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).