N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide

C19H22FN3O2 — CID 16674640

IUPACN-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide
SMILESO=C(CN1CCC(O)(c2ccccn2)CC1)NCc1ccc(F)cc1
InChIInChI=1S/C19H22FN3O2/c20-16-6-4-15(5-7-16)13-22-18(24)14-23-11-8-19(25,9-12-23)17-3-1-2-10-21-17/h1-7,10,25H,8-9,11-14H2,(H,22,24)
InChIKeyBHAKZVWVEHHDAN-UHFFFAOYSA-N
MW343.40 g/mol
LogP1.82
Rot. Bonds5

About N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide

N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide (PubChem CID 16674640) has the molecular formula C19H22FN3O2 and a molecular weight of 343.40 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide
PubChem CID16674640
Molecular FormulaC19H22FN3O2
Molecular Weight343.40 g/mol
Exact Mass343.17
IUPAC NameN-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide
SMILESO=C(CN1CCC(O)(c2ccccn2)CC1)NCc1ccc(F)cc1
InChIInChI=1S/C19H22FN3O2/c20-16-6-4-15(5-7-16)13-22-18(24)14-23-11-8-19(25,9-12-23)17-3-1-2-10-21-17/h1-7,10,25H,8-9,11-14H2,(H,22,24)
InChIKeyBHAKZVWVEHHDAN-UHFFFAOYSA-N
XLogP1.82
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.40
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide (CID 16674640) is N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide is O=C(CN1CCC(O)(c2ccccn2)CC1)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide?
The InChIKey is BHAKZVWVEHHDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O2/c20-16-6-4-15(5-7-16)13-22-18(24)14-23-11-8-19(25,9-12-23)17-3-1-2-10-21-17/h1-7,10,25H,8-9,11-14H2,(H,22,24).
What are the key properties of N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide?
N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide has a molecular weight of 343.40 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetamide is sourced from PubChem (CID 16674640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).