2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide

C15H19FN2O2 — CID 95294234

IUPAC2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide
SMILESNC(=O)C[C@@H]1CCCCN1C(=O)Cc1cccc(F)c1
InChIInChI=1S/C15H19FN2O2/c16-12-5-3-4-11(8-12)9-15(20)18-7-2-1-6-13(18)10-14(17)19/h3-5,8,13H,1-2,6-7,9-10H2,(H2,17,19)/t13-/m0/s1
InChIKeyVBHIKDGEWVXUDJ-ZDUSSCGKSA-N
MW278.33 g/mol
LogP1.62
Rot. Bonds4

About 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide

2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide (PubChem CID 95294234) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide.

Molecular Properties

Compound Name2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide
PubChem CID95294234
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC Name2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide
SMILESNC(=O)C[C@@H]1CCCCN1C(=O)Cc1cccc(F)c1
InChIInChI=1S/C15H19FN2O2/c16-12-5-3-4-11(8-12)9-15(20)18-7-2-1-6-13(18)10-14(17)19/h3-5,8,13H,1-2,6-7,9-10H2,(H2,17,19)/t13-/m0/s1
InChIKeyVBHIKDGEWVXUDJ-ZDUSSCGKSA-N
XLogP1.62
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(2-chloroethyl)piperidin-1-yl]-2-(3-fluorophenyl)ethanone
CID 63393969
1-[2-[(4-bromophenyl)methyl]pyrrolidin-1-yl]-2-(3-fluorophenyl)ethanone
CID 47079509
2-[(2S)-1-[(1R,2R)-2-(3-fluorophenyl)cyclopropanecarbonyl]piperidin-2-yl]acetamide
CID 124786387
2-[(2S)-1-[2-(2-methylphenyl)acetyl]piperidin-2-yl]acetamide
CID 95293984
2-amino-1-[2-[(3-fluorophenyl)methyl]pyrrolidin-1-yl]ethanone;hydrochloride
CID 119296824
3-amino-N-[[1-[2-[[2-(3-fluorophenyl)acetyl]amino]acetyl]piperidin-2-yl]methyl]propanamide
CID 120578113
2-(3-fluorophenyl)-1-[2-(4-fluorophenyl)pyrrolidin-1-yl]ethanone
CID 50747082
2-(3-fluorophenyl)-1-[(2R)-2-[(2S)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]ethanone
CID 129427864
2-(3-aminophenyl)-1-(2-ethylpiperidin-1-yl)ethanone
CID 62498346
1-[2-[(3-fluorophenyl)methyl]pyrrolidin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone
CID 55808363
1-[2-(aminomethyl)azepan-1-yl]-2-(3-methylphenyl)ethanone
CID 116639946
2-(3-fluorophenyl)-1-[(2R)-2-piperidin-4-ylpyrrolidin-1-yl]ethanone
CID 93394778

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide?
The IUPAC name of 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide (CID 95294234) is 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide.
What is the SMILES notation for 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide?
The canonical SMILES for 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide is NC(=O)C[C@@H]1CCCCN1C(=O)Cc1cccc(F)c1.
What is the InChIKey of 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide?
The InChIKey is VBHIKDGEWVXUDJ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H19FN2O2/c16-12-5-3-4-11(8-12)9-15(20)18-7-2-1-6-13(18)10-14(17)19/h3-5,8,13H,1-2,6-7,9-10H2,(H2,17,19)/t13-/m0/s1.
What are the key properties of 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide?
2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide has a molecular weight of 278.33 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-1-[2-(3-fluorophenyl)acetyl]piperidin-2-yl]acetamide is sourced from PubChem (CID 95294234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).