(2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide

C20H22ClNO2 — CID 7652970

IUPAC(2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide
SMILESC[C@H](Oc1ccc(-c2ccccc2)cc1Cl)C(=O)NC1CCCC1
InChIInChI=1S/C20H22ClNO2/c1-14(20(23)22-17-9-5-6-10-17)24-19-12-11-16(13-18(19)21)15-7-3-2-4-8-15/h2-4,7-8,11-14,17H,5-6,9-10H2,1H3,(H,22,23)/t14-/m0/s1
InChIKeyFEDUTYFIBDUCOJ-AWEZNQCLSA-N
MW343.85 g/mol
LogP4.83
Rot. Bonds5

About (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide

(2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide (PubChem CID 7652970) has the molecular formula C20H22ClNO2 and a molecular weight of 343.85 g/mol. Its IUPAC name is (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide.

Molecular Properties

Compound Name(2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide
PubChem CID7652970
Molecular FormulaC20H22ClNO2
Molecular Weight343.85 g/mol
Exact Mass343.13
IUPAC Name(2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide
SMILESC[C@H](Oc1ccc(-c2ccccc2)cc1Cl)C(=O)NC1CCCC1
InChIInChI=1S/C20H22ClNO2/c1-14(20(23)22-17-9-5-6-10-17)24-19-12-11-16(13-18(19)21)15-7-3-2-4-8-15/h2-4,7-8,11-14,17H,5-6,9-10H2,1H3,(H,22,23)/t14-/m0/s1
InChIKeyFEDUTYFIBDUCOJ-AWEZNQCLSA-N
XLogP4.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.85
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(2-chloro-4-phenylphenoxy)-N-(cyclohexylcarbamoyl)propanamide
CID 7653013
(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide
CID 7868566
[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-(2-chloro-4-phenylphenoxy)acetate
CID 8546814
(2S)-2-(4-chloronaphthalen-1-yl)oxy-N-cyclopentylpropanamide
CID 8021445
(2S)-N-cyclopropyl-2-(2,4-dichlorophenoxy)propanamide
CID 898785
(2R)-N-cyclopropyl-2-(2,4-dichlorophenoxy)propanamide
CID 898786
2-(4-acetyl-2-chlorophenoxy)-N-cyclopropylpropanamide
CID 113389862
(2S)-N-cyclopropyl-2-(2,4,5-trichlorophenoxy)propanamide
CID 7832796
(2R)-N-cyclopropyl-2-(2,4,5-trichlorophenoxy)propanamide
CID 7832797
(2S)-2-(2-chlorophenoxy)-N-(cyclohexylcarbamoyl)propanamide
CID 7815946
(2S)-N-cyclopentyl-2-(2-methoxyphenoxy)propanamide
CID 42082135
2-(4-chloro-2-methylphenoxy)-N-cycloheptylpropanamide
CID 2932831

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide?
The IUPAC name of (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide (CID 7652970) is (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide.
What is the SMILES notation for (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide?
The canonical SMILES for (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide is C[C@H](Oc1ccc(-c2ccccc2)cc1Cl)C(=O)NC1CCCC1.
What is the InChIKey of (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide?
The InChIKey is FEDUTYFIBDUCOJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H22ClNO2/c1-14(20(23)22-17-9-5-6-10-17)24-19-12-11-16(13-18(19)21)15-7-3-2-4-8-15/h2-4,7-8,11-14,17H,5-6,9-10H2,1H3,(H,22,23)/t14-/m0/s1.
What are the key properties of (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide?
(2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide has a molecular weight of 343.85 g/mol, XLogP of 4.83, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide is sourced from PubChem (CID 7652970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).