N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide

C20H22FN3O3 — CID 3053614

IUPACN-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide
SMILESO=C(CN1CCC(O)(c2ccccc2)CC1)NC(=O)Nc1cccc(F)c1
InChIInChI=1S/C20H22FN3O3/c21-16-7-4-8-17(13-16)22-19(26)23-18(25)14-24-11-9-20(27,10-12-24)15-5-2-1-3-6-15/h1-8,13,27H,9-12,14H2,(H2,22,23,25,26)
InChIKeyXXDZUAXVRGJADH-UHFFFAOYSA-N
MW371.41 g/mol
LogP2.46
Rot. Bonds4

About N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide

N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide (PubChem CID 3053614) has the molecular formula C20H22FN3O3 and a molecular weight of 371.41 g/mol. Its IUPAC name is N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide
PubChem CID3053614
Molecular FormulaC20H22FN3O3
Molecular Weight371.41 g/mol
Exact Mass371.16
IUPAC NameN-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide
SMILESO=C(CN1CCC(O)(c2ccccc2)CC1)NC(=O)Nc1cccc(F)c1
InChIInChI=1S/C20H22FN3O3/c21-16-7-4-8-17(13-16)22-19(26)23-18(25)14-24-11-9-20(27,10-12-24)15-5-2-1-3-6-15/h1-8,13,27H,9-12,14H2,(H2,22,23,25,26)
InChIKeyXXDZUAXVRGJADH-UHFFFAOYSA-N
XLogP2.46
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.41
LogP ≤ 52.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide?
The IUPAC name of N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide (CID 3053614) is N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide?
The canonical SMILES for N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide is O=C(CN1CCC(O)(c2ccccc2)CC1)NC(=O)Nc1cccc(F)c1.
What is the InChIKey of N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide?
The InChIKey is XXDZUAXVRGJADH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3O3/c21-16-7-4-8-17(13-16)22-19(26)23-18(25)14-24-11-9-20(27,10-12-24)15-5-2-1-3-6-15/h1-8,13,27H,9-12,14H2,(H2,22,23,25,26).
What are the key properties of N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide?
N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide has a molecular weight of 371.41 g/mol, XLogP of 2.46, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide is sourced from PubChem (CID 3053614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).