N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide

C18H21FN2O2 — CID 97016414

IUPACN-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide
SMILESCC[C@H](CNC(=O)Cc1ccc(C)nc1)Oc1cccc(F)c1
InChIInChI=1S/C18H21FN2O2/c1-3-16(23-17-6-4-5-15(19)10-17)12-21-18(22)9-14-8-7-13(2)20-11-14/h4-8,10-11,16H,3,9,12H2,1-2H3,(H,21,22)/t16-/m1/s1
InChIKeyCULSRXBPDOAIKW-MRXNPFEDSA-N
MW316.38 g/mol
LogP3.05
Rot. Bonds7

About N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide

N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide (PubChem CID 97016414) has the molecular formula C18H21FN2O2 and a molecular weight of 316.38 g/mol. Its IUPAC name is N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide
PubChem CID97016414
Molecular FormulaC18H21FN2O2
Molecular Weight316.38 g/mol
Exact Mass316.16
IUPAC NameN-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide
SMILESCC[C@H](CNC(=O)Cc1ccc(C)nc1)Oc1cccc(F)c1
InChIInChI=1S/C18H21FN2O2/c1-3-16(23-17-6-4-5-15(19)10-17)12-21-18(22)9-14-8-7-13(2)20-11-14/h4-8,10-11,16H,3,9,12H2,1-2H3,(H,21,22)/t16-/m1/s1
InChIKeyCULSRXBPDOAIKW-MRXNPFEDSA-N
XLogP3.05
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(3-fluorophenoxy)butyl]-2-methyl-3-[2-(6-methyl-3-pyridinyl)ethyl]guanidine
CID 109475803
N-[(2R)-2-(3-fluorophenoxy)butyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 97018614
N-[(2R)-2-(3-fluorophenoxy)butyl]-3-methyl-1,2-thiazole-4-carboxamide
CID 97255935
N-[(2S)-2-(3-fluorophenoxy)butyl]-1-methylpyrazole-4-carboxamide
CID 97018596
N-[2-(3-fluorophenoxy)butyl]-1H-pyrazole-5-carboxamide
CID 71974057
3-amino-N-[2-(3-fluorophenoxy)butyl]-3-phenylpropanamide;hydrochloride
CID 119952317
1-[2-(3-fluorophenoxy)butyl]-3-(1-hydroxybutan-2-yl)urea
CID 111974568
N-ethyl-2-(3-fluorophenoxy)butan-1-amine
CID 62459043
2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide
CID 120593918
N-[2-(3-fluorophenoxy)butyl]piperidine-2-carboxamide
CID 119340615
1-[2-(3-fluorophenoxy)butyl]-2,3-dimethylguanidine
CID 111970146
N-[3-(3,4-difluorophenoxy)-2-hydroxypropyl]-2-(6-methyl-3-pyridinyl)acetamide
CID 111102918

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide?
The IUPAC name of N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide (CID 97016414) is N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide.
What is the SMILES notation for N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide?
The canonical SMILES for N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide is CC[C@H](CNC(=O)Cc1ccc(C)nc1)Oc1cccc(F)c1.
What is the InChIKey of N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide?
The InChIKey is CULSRXBPDOAIKW-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H21FN2O2/c1-3-16(23-17-6-4-5-15(19)10-17)12-21-18(22)9-14-8-7-13(2)20-11-14/h4-8,10-11,16H,3,9,12H2,1-2H3,(H,21,22)/t16-/m1/s1.
What are the key properties of N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide?
N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide has a molecular weight of 316.38 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(3-fluorophenoxy)butyl]-2-(6-methyl-3-pyridinyl)acetamide is sourced from PubChem (CID 97016414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).