(2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide

C12H15ClN2O3 — CID 2631962

IUPAC(2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)[C@@H](C)Oc1ccccc1Cl
InChIInChI=1S/C12H15ClN2O3/c1-3-14-12(17)15-11(16)8(2)18-10-7-5-4-6-9(10)13/h4-8H,3H2,1-2H3,(H2,14,15,16,17)/t8-/m1/s1
InChIKeyHXDOWRASPRBIPG-MRVPVSSYSA-N
MW270.72 g/mol
LogP1.95
Rot. Bonds4

About (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide

(2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide (PubChem CID 2631962) has the molecular formula C12H15ClN2O3 and a molecular weight of 270.72 g/mol. Its IUPAC name is (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide
PubChem CID2631962
Molecular FormulaC12H15ClN2O3
Molecular Weight270.72 g/mol
Exact Mass270.08
IUPAC Name(2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)[C@@H](C)Oc1ccccc1Cl
InChIInChI=1S/C12H15ClN2O3/c1-3-14-12(17)15-11(16)8(2)18-10-7-5-4-6-9(10)13/h4-8H,3H2,1-2H3,(H2,14,15,16,17)/t8-/m1/s1
InChIKeyHXDOWRASPRBIPG-MRVPVSSYSA-N
XLogP1.95
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(aminomethyl)-3-chlorophenoxy]-N-(ethylcarbamoyl)propanamide
CID 114318401
N-(ethylcarbamoyl)-2-(2-methylphenoxy)propanamide
CID 60625657
(2R)-2-(2-chlorophenoxy)-N-(methylcarbamoyl)propanamide
CID 7815932
2-(2-chlorophenoxy)-N-[2-(ethylamino)ethyl]propanamide;hydrochloride
CID 119506587
2-[2-chloro-6-(hydroxymethyl)phenoxy]-N-(ethylcarbamoyl)propanamide
CID 115956282
2-(2-amino-3-methylphenoxy)-N-(ethylcarbamoyl)propanamide
CID 43438016
2-(2-chlorophenoxy)-N-[(2S)-2-hydroxypropyl]propanamide
CID 83030471
2-(2-chlorophenoxy)-N-[4-(ethylcarbamothioylamino)phenyl]propanamide
CID 43888076
2-(2-chlorophenoxy)-N-(2-chloroprop-2-enyl)propanamide
CID 115636700
(2S)-2-(2-chlorophenoxy)-N-(cyclohexylcarbamoyl)propanamide
CID 7815946
[1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 2-[(2-chlorophenyl)methoxy]benzoate
CID 16532605
2-(2-chlorophenoxy)-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 43058809

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide?
The IUPAC name of (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide (CID 2631962) is (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide.
What is the SMILES notation for (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide?
The canonical SMILES for (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide is CCNC(=O)NC(=O)[C@@H](C)Oc1ccccc1Cl.
What is the InChIKey of (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide?
The InChIKey is HXDOWRASPRBIPG-MRVPVSSYSA-N. The full InChI is InChI=1S/C12H15ClN2O3/c1-3-14-12(17)15-11(16)8(2)18-10-7-5-4-6-9(10)13/h4-8H,3H2,1-2H3,(H2,14,15,16,17)/t8-/m1/s1.
What are the key properties of (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide?
(2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide has a molecular weight of 270.72 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide is sourced from PubChem (CID 2631962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).