(2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide

C16H20N2O3 — CID 7757383

IUPAC(2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide
SMILESCOc1cc(C#N)ccc1O[C@H](C)C(=O)NC1CCCC1
InChIInChI=1S/C16H20N2O3/c1-11(16(19)18-13-5-3-4-6-13)21-14-8-7-12(10-17)9-15(14)20-2/h7-9,11,13H,3-6H2,1-2H3,(H,18,19)/t11-/m1/s1
InChIKeyHXIVSEUQKYJSDJ-LLVKDONJSA-N
MW288.35 g/mol
LogP2.39
Rot. Bonds5

About (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide

(2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide (PubChem CID 7757383) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide.

Molecular Properties

Compound Name(2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide
PubChem CID7757383
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name(2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide
SMILESCOc1cc(C#N)ccc1O[C@H](C)C(=O)NC1CCCC1
InChIInChI=1S/C16H20N2O3/c1-11(16(19)18-13-5-3-4-6-13)21-14-8-7-12(10-17)9-15(14)20-2/h7-9,11,13H,3-6H2,1-2H3,(H,18,19)/t11-/m1/s1
InChIKeyHXIVSEUQKYJSDJ-LLVKDONJSA-N
XLogP2.39
TPSA71.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-cyano-2-methoxyphenoxy)-N-cyclohexylpropanamide
CID 4808213
(2R)-2-[[2-(4-cyano-2-methoxyphenoxy)acetyl]amino]-N-cyclopentylpropanamide
CID 95164217
(2S)-2-(4-cyano-2-ethoxyphenoxy)-N-(cyclohexylcarbamoyl)propanamide
CID 7993066
(2S)-N-cyclopentyl-2-(2-methoxyphenoxy)propanamide
CID 42082135
N-cyclohexyl-2-(2-methoxyphenoxy)propanamide
CID 5003306
2-(4-cyano-2-methoxyphenoxy)-N-prop-2-ynylpropanamide
CID 43112207
2-(4-cyano-2-methoxyphenoxy)-N-(3-methylbutyl)propanamide
CID 43112203
(2S)-2-(4-cyano-2-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 7757378
(2R)-2-(4-cyano-2-methoxyphenoxy)-N-(2-methoxy-4-nitrophenyl)propanamide
CID 7757422
(2R)-N-(4-chlorophenyl)-2-(4-cyano-2-methoxyphenoxy)propanamide
CID 7757420
(2S)-2-(4-cyano-2-methoxyphenoxy)-N-(4-ethoxyphenyl)propanamide
CID 8978421
N-(3-chloro-4-methoxyphenyl)-2-(4-cyano-2-methoxyphenoxy)propanamide
CID 55422385

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide?
The IUPAC name of (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide (CID 7757383) is (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide.
What is the SMILES notation for (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide?
The canonical SMILES for (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide is COc1cc(C#N)ccc1O[C@H](C)C(=O)NC1CCCC1.
What is the InChIKey of (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide?
The InChIKey is HXIVSEUQKYJSDJ-LLVKDONJSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-11(16(19)18-13-5-3-4-6-13)21-14-8-7-12(10-17)9-15(14)20-2/h7-9,11,13H,3-6H2,1-2H3,(H,18,19)/t11-/m1/s1.
What are the key properties of (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide?
(2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide has a molecular weight of 288.35 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-cyano-2-methoxyphenoxy)-N-cyclopentylpropanamide is sourced from PubChem (CID 7757383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).