2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide

C19H22FN3O — CID 51093862

IUPAC2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(Cc1cccc(F)c1)NCc1cccnc1N1CCCCC1
InChIInChI=1S/C19H22FN3O/c20-17-8-4-6-15(12-17)13-18(24)22-14-16-7-5-9-21-19(16)23-10-2-1-3-11-23/h4-9,12H,1-3,10-11,13-14H2,(H,22,24)
InChIKeyZMKRVTMQHSOYTG-UHFFFAOYSA-N
MW327.40 g/mol
LogP3.07
Rot. Bonds5

About 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide

2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide (PubChem CID 51093862) has the molecular formula C19H22FN3O and a molecular weight of 327.40 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide
PubChem CID51093862
Molecular FormulaC19H22FN3O
Molecular Weight327.40 g/mol
Exact Mass327.17
IUPAC Name2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(Cc1cccc(F)c1)NCc1cccnc1N1CCCCC1
InChIInChI=1S/C19H22FN3O/c20-17-8-4-6-15(12-17)13-18(24)22-14-16-7-5-9-21-19(16)23-10-2-1-3-11-23/h4-9,12H,1-3,10-11,13-14H2,(H,22,24)
InChIKeyZMKRVTMQHSOYTG-UHFFFAOYSA-N
XLogP3.07
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.40
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(azocan-1-yl)-3-pyridinyl]methyl]-2-(3-chloro-4-hydroxyphenyl)acetamide
CID 56752509
N-[2-(3-fluorophenyl)ethyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 26996536
2-(3-fluorophenyl)-N-[2-oxo-2-[(2-pyrrolidin-1-yl-4-pyridinyl)methylamino]ethyl]acetamide
CID 55791258
2-(4-methoxyphenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide
CID 51093870
1-[3-[[[N-[2-(3-fluorophenyl)ethyl]-N'-methylcarbamimidoyl]amino]methyl]-2-pyridinyl]piperidine-3-carboxamide
CID 111395791
N-[(4-fluorophenyl)methyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 55755699
2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 51093842
N-[2-[[2-(3-fluorophenoxy)-3-pyridinyl]methylamino]-2-oxoethyl]-2-(3-fluorophenyl)acetamide
CID 55837977
2-(3-fluorophenyl)-N-(4-piperidin-1-ylphenyl)acetamide
CID 16552460
1-[3-[[[N-[(3-fluorophenyl)methyl]-N,N'-dimethylcarbamimidoyl]amino]methyl]-2-pyridinyl]piperidine-4-carboxamide
CID 111285593
2-(3-fluorophenyl)-N-(6-piperidin-1-ylpyridazin-3-yl)acetamide
CID 113038996
2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide
CID 110718968

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide (CID 51093862) is 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide is O=C(Cc1cccc(F)c1)NCc1cccnc1N1CCCCC1.
What is the InChIKey of 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide?
The InChIKey is ZMKRVTMQHSOYTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O/c20-17-8-4-6-15(12-17)13-18(24)22-14-16-7-5-9-21-19(16)23-10-2-1-3-11-23/h4-9,12H,1-3,10-11,13-14H2,(H,22,24).
What are the key properties of 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide?
2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide has a molecular weight of 327.40 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 51093862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).