N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide

C20H24FN3O2 — CID 119849102

IUPACN-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide
SMILESCC(CC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1)C1CCNCC1
InChIInChI=1S/C20H24FN3O2/c1-14(15-8-10-22-11-9-15)12-19(25)24-17-4-7-20(23-13-17)26-18-5-2-16(21)3-6-18/h2-7,13-15,22H,8-12H2,1H3,(H,24,25)
InChIKeySDNKSMPATBKMHQ-UHFFFAOYSA-N
MW357.43 g/mol
LogP3.98
Rot. Bonds6

About N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide

N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide (PubChem CID 119849102) has the molecular formula C20H24FN3O2 and a molecular weight of 357.43 g/mol. Its IUPAC name is N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide.

Molecular Properties

Compound NameN-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide
PubChem CID119849102
Molecular FormulaC20H24FN3O2
Molecular Weight357.43 g/mol
Exact Mass357.19
IUPAC NameN-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide
SMILESCC(CC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1)C1CCNCC1
InChIInChI=1S/C20H24FN3O2/c1-14(15-8-10-22-11-9-15)12-19(25)24-17-4-7-20(23-13-17)26-18-5-2-16(21)3-6-18/h2-7,13-15,22H,8-12H2,1H3,(H,24,25)
InChIKeySDNKSMPATBKMHQ-UHFFFAOYSA-N
XLogP3.98
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(4-methoxyphenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide
CID 119893842
N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119849091
3-[[5-(3-piperidin-4-ylbutanoylamino)-2-pyridinyl]oxy]benzamide;dihydrochloride
CID 119872984
N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-hydroxybutanamide
CID 110179642
N-[2-(4-fluoroanilino)-2-oxoethyl]-3-piperidin-4-ylbutanamide
CID 119758040
3-piperidin-4-yl-N-[4-(2,2,2-trifluoroethoxy)phenyl]butanamide;hydrochloride
CID 119698638
4-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-methoxybutanamide
CID 120595374
N-[5-(3-piperidin-4-ylbutanoylamino)-2-pyridinyl]benzamide
CID 119893892
N-(6-ethoxy-3-pyridinyl)-3-piperidin-3-ylbutanamide
CID 81049622
3-piperidin-4-yl-N-pyridin-4-ylbutanamide
CID 119827125
N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopropanecarboxamide
CID 117059029
methyl 4-(3-piperidin-4-ylbutanoylamino)benzoate
CID 119671385

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide?
The IUPAC name of N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide (CID 119849102) is N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide.
What is the SMILES notation for N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide?
The canonical SMILES for N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide is CC(CC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1)C1CCNCC1.
What is the InChIKey of N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide?
The InChIKey is SDNKSMPATBKMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FN3O2/c1-14(15-8-10-22-11-9-15)12-19(25)24-17-4-7-20(23-13-17)26-18-5-2-16(21)3-6-18/h2-7,13-15,22H,8-12H2,1H3,(H,24,25).
What are the key properties of N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide?
N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide has a molecular weight of 357.43 g/mol, XLogP of 3.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-piperidin-4-ylbutanamide is sourced from PubChem (CID 119849102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).