(2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide

C14H19Cl2NO2 — CID 2291416

IUPAC(2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide
SMILESCC[C@@H](C)CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H19Cl2NO2/c1-4-9(2)8-17-14(18)10(3)19-13-6-5-11(15)7-12(13)16/h5-7,9-10H,4,8H2,1-3H3,(H,17,18)/t9-,10-/m1/s1
InChIKeyBXRMUOJFVNNURK-NXEZZACHSA-N
MW304.22 g/mol
LogP3.92
Rot. Bonds6

About (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide

(2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide (PubChem CID 2291416) has the molecular formula C14H19Cl2NO2 and a molecular weight of 304.22 g/mol. Its IUPAC name is (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide
PubChem CID2291416
Molecular FormulaC14H19Cl2NO2
Molecular Weight304.22 g/mol
Exact Mass303.08
IUPAC Name(2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide
SMILESCC[C@@H](C)CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H19Cl2NO2/c1-4-9(2)8-17-14(18)10(3)19-13-6-5-11(15)7-12(13)16/h5-7,9-10H,4,8H2,1-3H3,(H,17,18)/t9-,10-/m1/s1
InChIKeyBXRMUOJFVNNURK-NXEZZACHSA-N
XLogP3.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.22
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-hydroxypropyl]propanamide
CID 39950205
3-[2-(2,4-dichlorophenoxy)propanoylamino]-2-hydroxypropanoic acid
CID 66165822
2-(2,4-dichlorophenoxy)-N-nonylpropanamide
CID 4130170
2-(2,4-dichlorophenoxy)-N-dodecylpropanamide
CID 4582803
4-[2-(2,4-dichlorophenoxy)propanoylamino]butanoic acid
CID 43239301
(2R)-2-(2,4-dichlorophenoxy)-N-ethoxypropanamide
CID 30690113
(2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-(dimethylamino)-2-phenylethyl]propanamide
CID 27230023
[(2S)-1-(ethylamino)-1-oxopropan-2-yl] (2R)-2-(2,4-dichlorophenoxy)propanoate
CID 8837826
2-[2-(2,4-dichlorophenoxy)propanoylamino]-3-methylpentanoic acid
CID 3825551
2-(2,4-dichlorophenoxy)-N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]propanamide
CID 60559289
(2S)-2-(2,4-dichlorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide
CID 7046351
(2S)-2-(2,4-dichlorophenoxy)-N-[(2S)-pentan-2-yl]propanamide
CID 2169643

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide?
The IUPAC name of (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide (CID 2291416) is (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide.
What is the SMILES notation for (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide?
The canonical SMILES for (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide is CC[C@@H](C)CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl.
What is the InChIKey of (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide?
The InChIKey is BXRMUOJFVNNURK-NXEZZACHSA-N. The full InChI is InChI=1S/C14H19Cl2NO2/c1-4-9(2)8-17-14(18)10(3)19-13-6-5-11(15)7-12(13)16/h5-7,9-10H,4,8H2,1-3H3,(H,17,18)/t9-,10-/m1/s1.
What are the key properties of (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide?
(2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide has a molecular weight of 304.22 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-methylbutyl]propanamide is sourced from PubChem (CID 2291416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).