(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide

C20H23NO2 — CID 7868566

IUPAC(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide
SMILESC[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NC1CCCC1
InChIInChI=1S/C20H23NO2/c1-15(20(22)21-18-9-5-6-10-18)23-19-13-11-17(12-14-19)16-7-3-2-4-8-16/h2-4,7-8,11-15,18H,5-6,9-10H2,1H3,(H,21,22)/t15-/m0/s1
InChIKeyVSJVUZXKFNUMQG-HNNXBMFYSA-N
MW309.41 g/mol
LogP4.18
Rot. Bonds5

About (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide

(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide (PubChem CID 7868566) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide.

Molecular Properties

Compound Name(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide
PubChem CID7868566
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide
SMILESC[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NC1CCCC1
InChIInChI=1S/C20H23NO2/c1-15(20(22)21-18-9-5-6-10-18)23-19-13-11-17(12-14-19)16-7-3-2-4-8-16/h2-4,7-8,11-15,18H,5-6,9-10H2,1H3,(H,21,22)/t15-/m0/s1
InChIKeyVSJVUZXKFNUMQG-HNNXBMFYSA-N
XLogP4.18
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-cycloheptyl-2-phenoxypropanamide
CID 669971
4-[1-(cyclohexylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 43084651
N-cyclopropyl-2-(4-phenoxyphenoxy)propanamide
CID 4793506
(2S)-2-(2-chloro-4-phenylphenoxy)-N-cyclopentylpropanamide
CID 7652970
N-cyclooctyl-2-(4-fluorophenoxy)propanamide
CID 42909316
2-(4-tert-butylphenoxy)-N-cycloheptylpropanamide
CID 19203440
N-cyclopentyl-2-(4-methylsulfonylphenoxy)propanamide
CID 51174549
methyl 4-[1-(cyclohexylamino)-1-oxopropan-2-yl]oxybenzoate
CID 17462378
N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide
CID 115495986
(2R)-N-cyclopropyl-2-(4-methoxyphenoxy)propanamide
CID 7865701
N-cyclododecyl-2-(3-methylphenoxy)propanamide
CID 3912808
N-cyclooctyl-2-(3-methylphenoxy)propanamide
CID 2976571

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide?
The IUPAC name of (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide (CID 7868566) is (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide.
What is the SMILES notation for (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide?
The canonical SMILES for (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide is C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NC1CCCC1.
What is the InChIKey of (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide?
The InChIKey is VSJVUZXKFNUMQG-HNNXBMFYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-15(20(22)21-18-9-5-6-10-18)23-19-13-11-17(12-14-19)16-7-3-2-4-8-16/h2-4,7-8,11-15,18H,5-6,9-10H2,1H3,(H,21,22)/t15-/m0/s1.
What are the key properties of (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide?
(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide has a molecular weight of 309.41 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide is sourced from PubChem (CID 7868566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).