(2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide

C14H19FN2O2 — CID 119336628

IUPAC(2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide
SMILESC[C@H](N)C(=O)Nc1ccc(OC2CCCC2)c(F)c1
InChIInChI=1S/C14H19FN2O2/c1-9(16)14(18)17-10-6-7-13(12(15)8-10)19-11-4-2-3-5-11/h6-9,11H,2-5,16H2,1H3,(H,17,18)/t9-/m0/s1
InChIKeyAVGMRTCWOMKSAB-VIFPVBQESA-N
MW266.32 g/mol
LogP2.43
Rot. Bonds4

About (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide

(2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide (PubChem CID 119336628) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide
PubChem CID119336628
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC Name(2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide
SMILESC[C@H](N)C(=O)Nc1ccc(OC2CCCC2)c(F)c1
InChIInChI=1S/C14H19FN2O2/c1-9(16)14(18)17-10-6-7-13(12(15)8-10)19-11-4-2-3-5-11/h6-9,11H,2-5,16H2,1H3,(H,17,18)/t9-/m0/s1
InChIKeyAVGMRTCWOMKSAB-VIFPVBQESA-N
XLogP2.43
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(4-cyclopentyloxy-3-fluorophenyl)-2-methylbutanamide
CID 120501730
(2R)-2-amino-N-(3-chloro-4-cyclopentyloxyphenyl)propanamide;hydrochloride
CID 119302889
3-amino-N-(4-cyclobutyloxy-3-fluorophenyl)-2-methyl-3-phenylpropanamide;hydrochloride
CID 119811119
2-amino-N-(3-cyclopentyloxyphenyl)propanamide
CID 82044663
1-(4-cyclopentyloxy-3-fluorophenyl)-3-[[(2S)-2-(2-methoxyethoxy)propanoyl]amino]urea
CID 97341856
7-amino-N-(4-cyclopentyloxy-3-fluorophenyl)heptanamide
CID 119806500
2-(6-aminopurin-9-yl)-N-(4-cyclobutyloxy-3-fluorophenyl)propanamide
CID 136553672
dimethyl (E)-2-(4-cyclopentyloxy-3-fluoroanilino)but-2-enedioate
CID 168568895
2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)-2-phenylpropanamide
CID 120593524
7-amino-N-(4-cyclobutyloxy-3-fluorophenyl)heptanamide;hydrochloride
CID 119811101
N-(4-cyclopentyloxy-3-fluorophenyl)pyrrolidine-2-carboxamide
CID 119336640
2-amino-N-(4-cyclobutyloxy-3-fluorophenyl)-2-methylpentanamide
CID 119811156

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide?
The IUPAC name of (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide (CID 119336628) is (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide is C[C@H](N)C(=O)Nc1ccc(OC2CCCC2)c(F)c1.
What is the InChIKey of (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide?
The InChIKey is AVGMRTCWOMKSAB-VIFPVBQESA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-9(16)14(18)17-10-6-7-13(12(15)8-10)19-11-4-2-3-5-11/h6-9,11H,2-5,16H2,1H3,(H,17,18)/t9-/m0/s1.
What are the key properties of (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide?
(2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide has a molecular weight of 266.32 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide is sourced from PubChem (CID 119336628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).